Structure Information
Structure

Compound Identification

SMILES

FC1=C(F)C(OCCCC2=CC=C(C=C2)C2=C([C@H]3CN(C[C@@H](C2)N3)C(=O)CCCC(=O)N2CCOCC2)C(=O)N(CC2=CC=CC=C2Cl)C2CC2)=C(F)C=C1

InChIKey

InChIKey=IUSDCSQKFSVQIS-JRYPVQGPSA-N

Formula

C42H46ClF3N4O5

Mass

779.3

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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 heteropolycyclic compounds

Substituents

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

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