Structure Information
Structure

Compound Identification

SMILES

COC(=O)C12C3CC(C4=CC=CC=C34)C1(C#N)C1(C#N)C3CC(C4=CC=CC=C34)C21C(=O)OC

InChIKey

InChIKey=WKJZZYUTZVSBKK-UHFFFAOYSA-N

Formula

C28H22N2O4

Mass

450.494

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Naphthalenes

Subclass

Naphthalenecarboxylic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Naphthalenecarboxylic acids

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

2-naphthalenecarboxylic acid - Tetralin - Indane - Dicarboxylic acid or derivatives - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - Carbonitrile - Nitrile - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as naphthalenecarboxylic acids. These are compounds containing a naphthalene moiety, which bears a carboxylic acid group one or more positions. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.

External Descriptors

Not available

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