Compound Identification
SMILES
OC1=CC=CC(C(=O)NCCC[N+]23CC[N+](CCOC4=C(F)C(F)=C5C=C(SC5=C4F)S(=O)(=O)NC(C4=CC(F)=C(C=C4)C#N)P([O-])([O-])=O)(CC2)CC3)=C1O
InChIKey
InChIKey=LVZPQTXRYVZGRG-UHFFFAOYSA-N
Formula
C34H34F4N5O9PS2
Mass
827.76
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoic acids and derivatives
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Level 5
Hydroxybenzoic acid derivatives
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Level 6
Salicylic acid and derivatives
- Level 7 Salicylamides
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Level 6
Salicylic acid and derivatives
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Level 5
Hydroxybenzoic acid derivatives
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Subclass
Benzoic acids and derivatives
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Hydroxybenzoic acid derivatives - Salicylic acid and derivatives
Direct Parent
Salicylamides
Alternative Parents
1-benzothiophenes Benzamides Phenol ethers 2,3,5-trisubstituted thiophenes Benzonitriles Benzoyl derivatives Catechols 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers N-alkylpiperazines Fluorobenzenes Organosulfonamides Aryl fluorides Vinylogous acids Tetraalkylammonium salts Aminosulfonyl compounds Organic phosphonic acids Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Nitriles Organic salts Organic zwitterions Amines Organophosphorus compounds Organic oxides Hydrocarbon derivatives Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Salicylamide - Benzamide - 1-benzothiophene - Benzothiophene - Phenol ether - 2,3,5-trisubstituted thiophene - Catechol - Benzoyl - Benzonitrile - Halobenzene - Fluorobenzene - Alkyl aryl ether - Phenol - 1-hydroxy-4-unsubstituted benzenoid - N-alkylpiperazine - 1-hydroxy-2-unsubstituted benzenoid - Aryl halide - Aryl fluoride - Piperazine - 1,4-diazinane - Organosulfonic acid amide - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Vinylogous acid - Quaternary ammonium salt - Heteroaromatic compound - Organophosphonic acid - Tetraalkylammonium salt - Sulfonyl - Thiophene - Aminosulfonyl compound - Organophosphonic acid derivative - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Carbonitrile - Nitrile - Organophosphorus compound - Organic oxygen compound - Organosulfur compound - Organic zwitterion - Organic salt - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Cyanide - Organic oxide - Organohalogen compound - Organonitrogen compound - Organofluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as salicylamides. These are carboxamide derivatives of salicylic acid. Salicylic acid is the ortho-hydroxylated derivative of benzoic acid.
External Descriptors
Not available