Compound Identification
SMILES
CC1=C(C)C2=C(CC[C@@](C)(CCCOC3=CC=C(C[C@@H]4SC(=O)NC4=O)C=C3)O2)C(C)=C1OC(=O)C1=CC=CC=C1Cl
InChIKey
InChIKey=NIYUFGSEZXEYER-VCTRWQRLSA-N
Formula
C33H34ClNO6S
Mass
608.15
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
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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
1-benzopyrans 2-halobenzoic acids and derivatives Phenol esters Benzoyl derivatives Phenol ethers Phenoxy compounds Chlorobenzenes Thiazolidinediones Alkyl aryl ethers Aryl chlorides Dicarboximides Vinylogous halides Carboxylic acid esters Thiocarbamic acid derivatives Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenol ester - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 1-benzopyran - Benzopyran - Chromane - Benzoate ester - Benzoyl - Phenol ether - Phenoxy compound - Chlorobenzene - Halobenzene - Thiazolidinedione - Alkyl aryl ether - Aryl halide - Aryl chloride - Vinylogous halide - Dicarboximide - Thiazolidine - Carboxylic acid ester - Thiocarbamic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Hydrocarbon derivative - Organohalogen 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