Structure Information
Structure

Compound Identification

SMILES

CC(C)O.CCCCC1=NC2=C(C=CN=C2)N1C1=CC=C(C=C1)C1=C(C(C2=CC=CC=C2Cl)C(C(=O)NC2=CC=CC=N2)=C(C)N1)C(=O)OCC

InChIKey

InChIKey=GKGQLRTYXZSHAM-UHFFFAOYSA-N

Formula

C40H43ClN6O4

Mass

707.27

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Cinnamic acids and derivatives

Subclass

Cinnamic acid esters

Intermediate Tree Nodes

Not available

Direct Parent

Cinnamic acid esters

Alternative Parents

Molecular Framework

Not available

Substituents

Cinnamic acid ester - 1-phenylimidazole - Imidazo-[4,5-c]pyridine - Imidazopyridine - Dihydropyridinecarboxylic acid derivative - N-arylamide - Dihydropyridine - Halobenzene - Chlorobenzene - Hydropyridine - Imidolactam - Benzenoid - Aryl chloride - N-substituted imidazole - Pyridine - Aryl halide - Monocyclic benzene moiety - Azole - Heteroaromatic compound - Vinylogous amide - Imidazole - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Secondary alcohol - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Enamine - Azacycle - Secondary aliphatic amine - Alcohol - Hydrocarbon derivative - Amine - Organic nitrogen compound - Carbonyl group - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cinnamic acid esters. These are compound containing an ester derivative of cinnamic acid.

External Descriptors

Not available

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