Structure Information
Structure

Compound Identification

SMILES

CN(C)C1=C(Br)C=C(C=C(C#N)C(=O)NC2=CC=C(Cl)C=C2)C=C1

InChIKey

InChIKey=JLKNVTUMFFBHSI-UHFFFAOYSA-N

Formula

C18H15BrClN3O

Mass

404.69

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Cinnamic acids and derivatives

Subclass

Cinnamic acid amides

Intermediate Tree Nodes

Not available

Direct Parent

Cinnamic acid amides

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Cinnamic acid amide - Anilide - Tertiary aliphatic/aromatic amine - N-arylamide - 2-bromoaniline - Dialkylarylamine - Aniline or substituted anilines - Halobenzene - Bromobenzene - Chlorobenzene - Benzenoid - Aryl bromide - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Amino acid or derivatives - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Nitrile - Carbonitrile - Carboxylic acid derivative - Amine - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as cinnamic acid amides. These are amides of cinnamic acids. Cinnamic acid is an aromatic compound containing a benzene and a carboxylic acid group forming 3-phenylprop-2-enoic acid.

External Descriptors

Not available

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