Structure Information
Structure

Compound Identification

SMILES

Cl.CCOC(=O)C1=CC=CC=C1C1=CC(OC[C@H](O)CNC(C)(C)CC2=CC3=CC=CC=C3C=C2)=C(C=C1)C#N

InChIKey

InChIKey=BGOKBURQYJMBLD-LNLSOMNWSA-N

Formula

C33H35ClN2O4

Mass

559.1

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Biphenyls and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Biphenylcarbonitriles

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Biphenylcarbonitrile - Benzoate ester - Naphthalene - Benzoic acid or derivatives - Phenoxy compound - Benzonitrile - Benzoyl - Phenol ether - Alkyl aryl ether - Aralkylamine - Amino acid or derivatives - 1,2-aminoalcohol - Carboxylic acid ester - Secondary alcohol - Carbonitrile - Nitrile - Ether - Secondary aliphatic amine - Secondary amine - Carboxylic acid derivative - Amine - Organic nitrogen compound - Organic oxide - Hydrochloride - Organic oxygen compound - Hydrocarbon derivative - Cyanide - Alcohol - Organonitrogen compound - Organooxygen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as biphenylcarbonitriles. These are organic compounds containing an acetonitrile with one hydrogen replaced by a biphenyl group.

External Descriptors

Not available

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