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Structure Information
Structure

Compound Identification

SMILES

OC(=O)C(O)=C(C#N)C1=CC=C(C=C1)C1=CC=CC2=CC=CC=C12

InChIKey

InChIKey=ZYQBEJQFCQZLMX-UHFFFAOYSA-N

Formula

C20H13NO3

Mass

315.328

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Phenylpyruvic acid derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyruvic acid derivatives

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Cinnamic acid - Cinnamic acid or derivatives - Enol-phenylpyruvate - Naphthalene - Carboxylic acid derivative - Nitrile - Carbonitrile - Monocarboxylic acid or derivatives - Enol - Carboxylic acid - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Cyanide - Organic oxygen compound - Organic nitrogen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyruvic acid derivatives. These are compounds containing a phenylpyruvic acid moiety, which consists of a phenyl group substituted at the second position by an pyruvic acid.

External Descriptors

Not available

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