Compound Identification
SMILES
OC1=C(C(C2CC2)C2=CC=C(CNC3=CC=CC=C3C(=O)OCC3=CC=CC=C3)S2)C(=O)OC2=C1CCCCCC2
InChIKey
InChIKey=WHAIKCKGTRPISQ-UHFFFAOYSA-N
Formula
C34H35NO5S
Mass
569.72
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
Aminobenzoic acids and derivatives Benzyloxycarbonyls Aniline and substituted anilines Benzoyl derivatives Phenylalkylamines 2,5-disubstituted thiophenes Pyranones and derivatives Secondary alkylarylamines Heteroaromatic compounds Vinylogous acids Vinylogous amides Lactones Carboxylic acid esters Amino acids and derivatives Oxacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aminobenzoic acid or derivatives - Benzoate ester - Benzyloxycarbonyl - Benzoyl - Phenylalkylamine - Aniline or substituted anilines - Pyranone - Aralkylamine - Secondary aliphatic/aromatic amine - 2,5-disubstituted thiophene - Pyran - Heteroaromatic compound - Thiophene - Vinylogous amide - Vinylogous acid - Amino acid or derivatives - Carboxylic acid ester - Lactone - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Secondary amine - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - 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