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Structure Information
Structure

Compound Identification

SMILES

CN(C)CCC1=CC=C(N\C(=C2/C(=O)NC3=C2C=CC(Cl)=C3)C2=CC=C(CCC(O)=O)C=C2)C=C1

InChIKey

InChIKey=LSGCZBZIUYDZGH-RQZHXJHFSA-N

Formula

C28H28ClN3O3

Mass

490.0

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Phenylpropanoic acids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpropanoic acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3-phenylpropanoic-acid - Phenethylamine - Indole or derivatives - Dihydroindole - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - Aralkylamine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Tertiary amine - Secondary carboxylic acid amide - Lactam - Carboxamide group - Amino acid - Amino acid or derivatives - Tertiary aliphatic amine - Azacycle - Carboxylic acid derivative - Carboxylic acid - Enamine - Organoheterocyclic compound - Secondary amine - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Amine - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid.

External Descriptors

Not available

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