Structure Information
Structure

Compound Identification

SMILES

Cl.OC(=O)C1=CC(NCC(CCC2=CC=C(C=C2)C#N)C2(O)CCNCC2)=CC=C1

InChIKey

InChIKey=JCCXIJAAFMUXGV-UHFFFAOYSA-N

Formula

C23H28ClN3O3

Mass

429.95

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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 heteromonocyclic compounds

Substituents

Phenylbutylamine - Aminobenzoic acid - Aminobenzoic acid or derivatives - Benzoic acid - Benzoic acid or derivatives - Benzoyl - Benzonitrile - Aniline or substituted anilines - Phenylalkylamine - Aralkylamine - Secondary aliphatic/aromatic amine - Piperidine - Tertiary alcohol - 1,3-aminoalcohol - Amino acid or derivatives - Amino acid - Organoheterocyclic compound - Secondary amine - Carboxylic acid - Carboxylic acid derivative - Nitrile - Secondary aliphatic amine - Carbonitrile - Azacycle - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrochloride - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Amine - Alcohol - Aromatic heteromonocyclic 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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