Compound Identification
SMILES
COC1=C(OC)C=C(C=C2SC(=O)N(CCNC(=O)COC(=O)C3=CC(Cl)=CC=C3)C2=O)C=C1
InChIKey
InChIKey=WBWGJFCFYTXPHG-UHFFFAOYSA-N
Formula
C23H21ClN2O7S
Mass
504.94
Taxonomic Classification
Taxonomy Tree
-
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
-
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
3-halobenzoic acids and derivatives Dimethoxybenzenes Phenoxy compounds Anisoles Benzoyl derivatives Thiazolidinediones Alkyl aryl ethers Chlorobenzenes Aryl chlorides Dicarboximides Thiocarbamic acid derivatives Secondary carboxylic acid amides Carboxylic acid esters Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives Organic oxides Organochlorides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Dimethoxybenzene - O-dimethoxybenzene - Benzoate ester - Methoxybenzene - Phenoxy compound - Benzoyl - Anisole - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Thiazolidinedione - Aryl chloride - Aryl halide - Dicarboximide - Thiazolidine - Thiocarbamic acid derivative - Carboxylic acid ester - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organooxygen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxide - Aromatic heteromonocyclic 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