Compound Identification
SMILES
CC1CCCN(C1)S(=O)(=O)C1=C(Cl)C=CC(=C1)C(=O)OCC(=O)NC(=O)C1=CC=CN1C
InChIKey
InChIKey=GIFGDNGZMKMZEX-UHFFFAOYSA-N
Formula
C21H24ClN3O6S
Mass
481.95
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
-
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
4-halobenzoic acids and derivatives Benzenesulfonamides Benzenesulfonyl compounds Pyrrole carboxamides Benzoyl derivatives Chlorobenzenes Piperidines Organosulfonamides Aryl chlorides N-methylpyrroles Sulfonyls N-unsubstituted carboxylic acid imides Dicarboximides Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Carbonyl compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzenesulfonamide - Benzoate ester - Halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Benzenesulfonyl group - Benzoyl - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - N-methylpyrrole - Organosulfonic acid amide - Piperidine - Substituted pyrrole - Heteroaromatic compound - Carboxylic acid imide - Dicarboximide - Sulfonyl - Carboxylic acid imide, n-unsubstituted - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrole - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Aromatic heteromonocyclic 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