Structure Information
Structure

Compound Identification

SMILES

COC1=CC(N)=C(Cl)C=C1C(=O)OCC1CCN(C[C@@H](N)CC2=CNC3=CC=CC=C23)CC1

InChIKey

InChIKey=OQKOAMQJWCCPOD-SFHVURJKSA-N

Formula

C25H31ClN4O3

Mass

471.0

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Indoles and derivatives

Subclass

Tryptamines and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Tryptamines and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Triptan - O-methoxybenzoic acid or derivatives - Aminobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Benzoate ester - Halobenzoic acid or derivatives - 3-alkylindole - Aminophenyl ether - Benzoic acid or derivatives - Indole - Methoxyaniline - Aniline or substituted anilines - Phenol ether - Methoxybenzene - Benzoyl - Anisole - Phenoxy compound - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aralkylamine - Substituted pyrrole - Piperidine - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyrrole - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Amino acid or derivatives - Carboxylic acid derivative - Ether - Azacycle - Amine - Primary amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Primary aliphatic amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as tryptamines and derivatives. These are compounds containing the tryptamine backbone, which is structurally characterized by an indole ring substituted at the 3-position by an ethanamine.

External Descriptors

Not available

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