Compound Identification
SMILES
CC1=C(C=C(NC(=O)COC(=O)C2=CC=CC=C2C2=NC3=CC=CC=C3S2)C=C1)S(=O)(=O)N1CCCCC1
InChIKey
InChIKey=FTFWODRIUJCGML-UHFFFAOYSA-N
Formula
C28H27N3O5S2
Mass
549.66
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
- Level 5 Benzoic acid esters
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Subclass
Benzoic acids and derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acid esters
Alternative Parents
Benzenesulfonamides Anilides Benzenesulfonyl compounds Benzothiazoles Benzoyl derivatives N-arylamides Toluenes Piperidines Organosulfonamides Heteroaromatic compounds Thiazoles Sulfonyls Carboxylic acid esters Secondary carboxylic acid amides Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzenesulfonamide - Benzoate ester - Benzenesulfonyl group - 1,3-benzothiazole - Anilide - Benzoyl - N-arylamide - Toluene - Piperidine - Organosulfonic acid amide - Azole - Heteroaromatic compound - Thiazole - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors
Not available