Structure Information
Structure

Compound Identification

SMILES

CC1=CN(CCCN(CC2=C[N+]([O-])=CC=C2)C(=O)[C@H]2CN(CCN2C(=O)OC2CCCCC2)[C@H]2C3=C(CCC4=C2N=CC=C4)C=C(Cl)C=C3)C=N1

InChIKey

InChIKey=UKYSQDOVSCMBRY-BZFILIQBSA-N

Formula

C39H46ClN7O4

Mass

712.29

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzocycloheptapyridines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzocycloheptapyridines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzocycloheptapyridine - Alpha-amino acid or derivatives - Piperazine-2-carboxamide - Piperazine-1-carboxylic acid - Imidazolyl carboxylic acid derivative - N-alkylpiperazine - Aralkylamine - Benzenoid - N-substituted imidazole - Aryl chloride - 1,4-diazinane - Pyridinium - Pyridine - Piperazine - Aryl halide - Imidazole - Carbamic acid ester - Tertiary carboxylic acid amide - Azole - Heteroaromatic compound - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Azacycle - Carboxylic acid derivative - Organic salt - Amine - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzocycloheptapyridines. These are aromatic compounds containing a benzene ring and a pyridine ring fused to a seven membered carbocycle.

External Descriptors

Not available

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