Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)C1(CCCN(C)[C@H](C)C(O)=O)CCC2=C1C=CC(Cl)=C2

InChIKey

InChIKey=XFAQOSVVKXAJGW-ADRQNKRLSA-N

Formula

C23H28ClNO3

Mass

401.93

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Phenylbutylamines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylbutylamines

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Alanine or derivatives - Phenylbutylamine - Alpha-amino acid - Alpha-amino acid or derivatives - D-alpha-amino acid - Indane - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Aralkylamine - Aryl chloride - Aryl halide - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Amino acid - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Ether - Carboxylic acid - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Amine - Organic oxide - Organonitrogen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylbutylamines. These are compounds containing a phenylbutylamine moiety, which consists of a phenyl group substituted at the fourth carbon by an butan-1-amine.

External Descriptors

Not available

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