Compound Identification
SMILES
CCCCOC(=O)C1=CC=C(OC(=O)C2=C(C)C3=C(S2)N=CN(CC2=CC=CC=C2Cl)C3=O)C=C1
InChIKey
InChIKey=NWRVMPYRQZMQJP-UHFFFAOYSA-N
Formula
C26H23ClN2O5S
Mass
510.99
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 Thienopyrimidines Thiophene carboxylic acids and derivatives Benzoyl derivatives Phenoxy compounds Pyrimidones Chlorobenzenes Aryl chlorides Heteroaromatic compounds Lactams Carboxylic acid esters Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Organonitrogen compounds Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoate ester - Phenol ester - Thienopyrimidine - Phenoxy compound - Benzoyl - Thiophene carboxylic acid or derivatives - Chlorobenzene - Halobenzene - Pyrimidone - Aryl halide - Pyrimidine - Aryl chloride - Heteroaromatic compound - Thiophene - Carboxylic acid ester - Lactam - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organic oxygen compound - Organic nitrogen 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