Structure Information
Structure

Compound Identification

SMILES

COC(=O)N1CC2CC(C3=CC=C(CCCOC4=C(F)C=CC(F)=C4F)C=C3)=C([C@@H](C1)N2)C(=O)N(CC1=CC=CC=C1Cl)C1CC1

InChIKey

InChIKey=URGYSVJWSVQVLF-BXFARTRRSA-N

Formula

C35H35ClF3N3O4

Mass

654.13

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