Structure Information
Structure

Compound Identification

SMILES

O=C1CC(CN1CC1CCN(CCCC2=CC=CC=C2)CC1)NC1=CC=CC=C1C#N

InChIKey

InChIKey=ORKMBLVVISFSHO-UHFFFAOYSA-N

Formula

C26H32N4O

Mass

416.569

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Amino acids and derivatives

Direct Parent

Beta amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Beta amino acid or derivatives - Phenylpropylamine - Benzonitrile - Aniline or substituted anilines - Phenylalkylamine - Secondary aliphatic/aromatic amine - Aralkylamine - Monocyclic benzene moiety - Piperidine - Benzenoid - N-alkylpyrrolidine - Pyrrolidone - 2-pyrrolidone - Pyrrolidine - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Nitrile - Carbonitrile - Azacycle - Secondary amine - Cyanide - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Amine - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.

External Descriptors

Not available

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