Structure Information
Structure

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

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Taxonomic Classification

Taxonomy Tree

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

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

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