Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=C(O1)C(=O)C(\Br)=C\C1=C(Cl)C=C(Cl)C=C1

InChIKey

InChIKey=ZNIBYWWPRUUZQN-UITAMQMPSA-N

Formula

C13H6BrCl2NO4

Mass

391.0

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Cinnamic acids and derivatives

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Cinnamic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Cinnamic acid or derivatives - 2-nitrofuran - Aryl ketone - 1,3-dichlorobenzene - Nitroaromatic compound - Chlorobenzene - Halobenzene - Monocyclic benzene moiety - Alpha-branched alpha,beta-unsaturated-ketone - Benzenoid - Aryl halide - Aryl chloride - Heteroaromatic compound - Alpha-haloketone - Enone - Furan - Alpha,beta-unsaturated ketone - Acryloyl-group - Organic nitro compound - C-nitro compound - Ketone - Oxacycle - Bromoalkene - Haloalkene - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Vinyl bromide - Vinyl halide - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organic oxygen compound - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic salt - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as cinnamic acids and derivatives. These are organic aromatic compounds containing a benzene and a carboxylic acid group (or a derivative thereof) forming 3-phenylprop-2-enoic acid.

External Descriptors

Not available

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