Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C=C(C=CC(=O)OCC2=C(F)C=CC=C2Cl)C=C1

InChIKey

InChIKey=DTGLQXGCOUYXKW-UHFFFAOYSA-N

Formula

C18H16ClFO4

Mass

350.77

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Cinnamic acids and derivatives

Subclass

Hydroxycinnamic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Coumaric acids and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Coumaric acid or derivatives - Cinnamic acid ester - Benzyloxycarbonyl - Dimethoxybenzene - O-dimethoxybenzene - Anisole - Methoxybenzene - Styrene - Phenol ether - Phenoxy compound - Fatty acid ester - Chlorobenzene - Fluorobenzene - Halobenzene - Alkyl aryl ether - Fatty acyl - Aryl chloride - Benzenoid - Aryl halide - Monocyclic benzene moiety - Aryl fluoride - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Carbonyl group - Organohalogen compound - Organochloride - Organofluoride - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as coumaric acids and derivatives. These are aromatic compounds containing Aromatic compounds containing a cinnamic acid moiety (or a derivative thereof) hydroxylated at the C2 (ortho-), C3 (meta-), or C4 (para-) carbon atom of the benzene ring.

External Descriptors

Not available

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