Structure Information
Structure

Compound Identification

SMILES

Cl.CN(C[C@H]1CCC2=C(C=CC(=C2)C#N)[C@H]1C1=CC=CC=C1)CC(O)=O

InChIKey

InChIKey=AJKWYEIPBLFQBV-WKOQGQMTSA-N

Formula

C21H23ClN2O2

Mass

370.88

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Tetralins

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Tetralins

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Alpha-amino acid - Alpha-amino acid or derivatives - Tetralin - Aralkylamine - Monocyclic benzene moiety - Amino acid or derivatives - Amino acid - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrochloride - Hydrocarbon derivative - Carbonyl group - Organic oxide - Cyanide - Amine - Organic oxygen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as tetralins. These are polycyclic aromatic compounds containing a tetralin moiety, which consists of a benzene fused to a cyclohexane.

External Descriptors

Not available

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