Structure Information
Structure

Compound Identification

SMILES

CC1=CC(C(N)=O)=C(OCC2=CC=CC=C2)C(=C1)S(=O)(=O)C1=CC=C(CCN[C@H](CC2=CC=CC=C2)[C@H](O)C2=CC(Cl)=CC=C2)C=C1

InChIKey

InChIKey=ZENIEGZZODNTMP-QZCRLSDHSA-N

Formula

C38H37ClN2O5S

Mass

669.23

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Linear 1,3-diarylpropanoids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Linear 1,3-diarylpropanoids

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Linear 1,3-diarylpropanoid - Amphetamine or derivatives - Benzamide - Benzoic acid or derivatives - Phenethylamine - Toluamide - M-toluamide - Benzenesulfonyl group - Phenoxy compound - Benzoyl - Phenol ether - Aralkylamine - Toluene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Sulfonyl - Sulfone - Amino acid or derivatives - 1,2-aminoalcohol - Secondary alcohol - Primary carboxylic acid amide - Carboxamide group - Ether - Secondary amine - Carboxylic acid derivative - Secondary aliphatic amine - Organic oxygen compound - Alcohol - Organic nitrogen compound - Organic oxide - Organochloride - Aromatic alcohol - Hydrocarbon derivative - Organonitrogen compound - Amine - Organohalogen compound - Organosulfur compound - Organooxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as linear 1,3-diarylpropanoids. These are organic compounds with a structure based on a C6-C3-C6 skeleton, where the two benzene rings are not linked together.

External Descriptors

Not available

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