Structure Information
Structure

Compound Identification

SMILES

CC1=C(NCCCCNC(=O)OC(C)(C)C)C(=C(N=C1Cl)N(CC1=CC=CC=C1)CC1=CC=CC=C1)[N+]([O-])=O

InChIKey

InChIKey=JMJJXMFMLJSYGW-UHFFFAOYSA-N

Formula

C29H36ClN5O4

Mass

554.09

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzylamines

Intermediate Tree Nodes

Not available

Direct Parent

2-benzylaminopyridines

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

2-benzylaminopyridine - Nitroaromatic compound - Dialkylarylamine - Aminopyridine - 2-halopyridine - Methylpyridine - Secondary aliphatic/aromatic amine - Aryl chloride - Aryl halide - Pyridine - Imidolactam - Heteroaromatic compound - Carbamic acid ester - C-nitro compound - Organic nitro compound - Organic oxoazanium - Azacycle - Organoheterocyclic compound - Secondary amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Amine - Organohalogen compound - Organic oxygen compound - Organic salt - Organic zwitterion - Organic oxide - Carbonyl group - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as 2-benzylaminopyridines. These are aromatic compounds containing pyridine ring substituted at the 2-position by a benzylamine group.

External Descriptors

Not available

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