Compound Identification
SMILES
CC1=C(OC(=O)C2=CC=CC=C2)C(C)=C2CCC(C)(COC3=CC=C(CC4SC(=O)NC4=O)C=C3)OC2=C1C
InChIKey
InChIKey=CPUZQNCYTMEBRA-UHFFFAOYSA-N
Formula
C31H31NO6S
Mass
545.65
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
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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
Phenol esters 1-benzopyrans Phenoxy compounds Phenol ethers Benzoyl derivatives Thiazolidinediones Alkyl aryl ethers Dicarboximides Thiocarbamic acid derivatives Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoate ester - Chromane - Benzopyran - 1-benzopyran - Phenol ester - Phenoxy compound - Benzoyl - Phenol ether - Alkyl aryl ether - Thiazolidinedione - Dicarboximide - Thiazolidine - Carboxylic acid ester - Thiocarbamic acid derivative - Oxacycle - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Ether - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen 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