Compound Identification
SMILES
ClC1=CC=C(S1)C(=O)COC(=O)C1=CC=CC=C1C(=O)NC12CC3CC(CC(C3)C1)C2
InChIKey
InChIKey=TVCYUPUTYAJAPD-UHFFFAOYSA-N
Formula
C24H24ClNO4S
Mass
457.97
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
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Subclass
Benzoic acids and derivatives
-
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
Benzamides Benzoyl derivatives Aryl alkyl ketones 2,5-disubstituted thiophenes Aryl chlorides Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoate ester - Benzamide - Benzoyl - Aryl alkyl ketone - Aryl ketone - 2,5-disubstituted thiophene - Aryl chloride - Aryl halide - Heteroaromatic compound - Thiophene - Carboxamide group - Carboxylic acid ester - Ketone - Secondary carboxylic acid amide - Carboxylic acid derivative - Organoheterocyclic compound - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxide - 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