Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC(C)=O)C(Br)=CC(C=C(C#N)C(=O)NC2=C(C=C(Cl)C=C2)[N+]([O-])=O)=C1

InChIKey

InChIKey=VXJAPNYYVKFANF-UHFFFAOYSA-N

Formula

C19H13BrClN3O6

Mass

494.68

Export to:

JSON SDF CSV

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 - Phenol ester - Nitrobenzene - Anilide - Phenoxy compound - Nitroaromatic compound - Anisole - Phenol ether - N-arylamide - Methoxybenzene - Alkyl aryl ether - Halobenzene - Chlorobenzene - Bromobenzene - Aryl halide - Aryl chloride - Benzenoid - Aryl bromide - Monocyclic benzene moiety - Carboxylic acid ester - Organic nitro compound - Secondary carboxylic acid amide - C-nitro compound - Carboxamide group - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organic oxoazanium - Organooxygen compound - Organic zwitterion - Organopnictogen compound - Organonitrogen compound - Organic oxide - Organochloride - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organobromide - Carbonyl group - Organohalogen 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

Previous Back Next