Structure Information
Structure

Compound Identification

SMILES

CN(C)C1=CC=C(C=CC(=O)C2=C(NC3=[N+](C)C4=CC=CC=C4N23)C2=CC=C(Br)C=C2)C=C1

InChIKey

InChIKey=PSPGSRZXLICXNC-UHFFFAOYSA-O

Formula

C27H24BrN4O

Mass

500.419

Export to:

JSON SDF CSV

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 heteropolycyclic compounds

Substituents

Cinnamic acid or derivatives - 4-phenylimidazole - 5-phenylimidazole - Benzimidazole - Styrene - Tertiary aliphatic/aromatic amine - Aryl ketone - Aniline or substituted anilines - Dialkylarylamine - Bromobenzene - Imidazole-4-carbonyl group - Halobenzene - Benzenoid - Aryl bromide - Aryl halide - N-substituted imidazole - Monocyclic benzene moiety - Acryloyl-group - Azole - Heteroaromatic compound - Enone - Vinylogous amide - Imidazole - Alpha,beta-unsaturated ketone - Ketone - Tertiary amine - Organoheterocyclic compound - Azacycle - Amine - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organic cation - Aromatic heteropolycyclic 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

Previous Back Next