Structure Information
Structure

Compound Identification

SMILES

CC1=CN(C[C@H]2CCCN(C2)C(=O)[C@H]2CN(CCN2C(=O)OC(C)(C)C)C2C3=C(CCC4=CC(F)=CN=C24)C=C(Cl)C=C3)C=N1

InChIKey

InChIKey=WQHSIAXUOJNUFB-FWLUSMSSSA-N

Formula

C34H42ClFN6O3

Mass

637.2

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