Structure Information
Structure

Compound Identification

SMILES

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

InChIKey

InChIKey=CHCYOAPAXAOERX-RJVZZWLCSA-N

Formula

C35H43ClN6O4

Mass

647.22

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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 - N-acyl-piperidine - Piperazine-2-carboxamide - Imidazolyl carboxylic acid derivative - N-alkylpiperazine - Aralkylamine - N-substituted imidazole - Aryl chloride - Aryl halide - Piperazine - 1,4-diazinane - Benzenoid - Pyridine - Piperidine - Imidazole - Heteroaromatic compound - Azole - Tertiary carboxylic acid amide - Amino acid or derivatives - Amino acid - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Azacycle - Carboxylic acid - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Amine - Organic oxide - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organochloride - 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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