Structure Information
Structure

Compound Identification

SMILES

CC1=C(CC(=O)NC2=CC=CC(=C2)C(CC(O)=O)C2CCCO2)C=CC2=C1OC(NC1=CC=CC=C1Cl)=N2

InChIKey

InChIKey=LUNSQRORCCQZNC-UHFFFAOYSA-N

Formula

C29H28ClN3O5

Mass

534.01

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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 - Anilide - Benzoxazole - N-arylamide - Aniline or substituted anilines - Halobenzene - Chlorobenzene - Aryl halide - Benzenoid - Aryl chloride - Monocyclic benzene moiety - Azole - Oxazole - Oxolane - Heteroaromatic compound - Amino acid - Carboxamide group - Secondary carboxylic acid amide - Amino acid or derivatives - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Secondary amine - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Amine - Organic nitrogen compound - 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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