Compound Identification
SMILES
CC(C)(C)C(=O)C1=C(COC(=O)C2=CC=CC=C2)CS(=O)(=O)[C@H]2[C@@H](Cl)C(=O)N12
InChIKey
InChIKey=NQTRBTDEWNGRLD-GUYCJALGSA-N
Formula
C19H20ClNO6S
Mass
425.88
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
Cephems Benzoyl derivatives 1,3-thiazines Tertiary carboxylic acid amides Sulfones Ketones Carboxylic acid esters Azetidines Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoate ester - Cephem - Benzoyl - Meta-thiazine - Beta-lactam - Sulfone - Tertiary carboxylic acid amide - Azetidine - Carboxamide group - Lactam - Ketone - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Alkyl chloride - Hydrocarbon derivative - Organohalogen compound - Organochloride - Carbonyl group - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Organonitrogen compound - Alkyl halide - 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