Structure Information
Structure

Compound Identification

SMILES

CC1=CC(C(=O)COC(=O)C2=CC(=C(F)C=C2)S(=O)(=O)N2CCOCC2)=C(C)N1CC=C

InChIKey

InChIKey=NTJYMWWRPAJFCI-UHFFFAOYSA-N

Formula

C22H25FN2O6S

Mass

464.51

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzenesulfonamide - Benzoate ester - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzenesulfonyl group - Benzoyl - Aryl ketone - Aryl alkyl ketone - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Morpholine - Oxazinane - Substituted pyrrole - Organosulfonic acid amide - Vinylogous amide - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrole - Heteroaromatic compound - Sulfonyl - Carboxylic acid ester - Ketone - Organoheterocyclic compound - Azacycle - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Monocarboxylic acid or derivatives - Ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aldehyde - Organohalogen compound - Organofluoride - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - 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

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