Structure Information
Structure

Compound Identification

SMILES

CCCCCOC(CCCC)C1=CC=CC(C2=CSC(NC(=O)C3=CC(F)=C(\C=C(/C)C(O)=O)C(F)=C3)=N2)=C1F

InChIKey

InChIKey=UHBSOVTXTOTVIC-NBVRZTHBSA-N

Formula

C30H33F3N2O4S

Mass

574.66

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Cinnamic acids and derivatives

Subclass

Cinnamic acids

Intermediate Tree Nodes

Not available

Direct Parent

Cinnamic acids

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Cinnamic acid - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzylether - Benzoyl - Fluorobenzene - Halobenzene - 2,4-disubstituted 1,3-thiazole - Aryl fluoride - Benzenoid - Monocyclic benzene moiety - Aryl halide - Heteroaromatic compound - Thiazole - Azole - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Ether - Dialkyl ether - Organoheterocyclic compound - Carboxylic acid - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as cinnamic acids. These are organic aromatic compounds containing a benzene and a carboxylic acid group forming 3-phenylprop-2-enoic acid.

External Descriptors

Not available

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