Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC(CN(C2CC2)C(=O)C2=C(C[C@H]3CNC[C@H]2N3)C2=CC=C(CN(C)CC3=CC=CC=C3Cl)C=C2)=C1C

InChIKey

InChIKey=OIPXKRIDPJLWNJ-GMCHKSTQSA-N

Formula

C35H41ClN4O2

Mass

585.19

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 - Phenoxy compound - Anisole - Phenol ether - Phenylmethylamine - Methoxybenzene - Benzylamine - Alkyl aryl ether - Halobenzene - Aralkylamine - Chlorobenzene - Toluene - Aryl chloride - Benzenoid - 1,4-diazinane - Piperazine - Monocyclic benzene moiety - Aryl halide - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Ether - Secondary amine - Secondary aliphatic amine - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organonitrogen compound - Amine - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organohalogen compound - Organochloride - 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