Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CN=C(NC2=CC=C(Cl)C=C2)N=C1NCCCN(CC1=CC=CC=C1)CC1=CC=CC=C1

InChIKey

InChIKey=XQOGFPCWFNNKPM-UHFFFAOYSA-N

Formula

C27H27ClN6O2

Mass

503.0

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Phenylmethylamines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylmethylamines

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Nitroaromatic compound - Benzylamine - Phenylmethylamine - Aniline or substituted anilines - Aminopyrimidine - Chlorobenzene - Halobenzene - Aralkylamine - Aryl chloride - Aryl halide - Pyrimidine - Imidolactam - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Tertiary amine - Tertiary aliphatic amine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Azacycle - Organic oxoazanium - Organic salt - Organochloride - Organonitrogen compound - Organohalogen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic zwitterion - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.

External Descriptors

Not available

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