Structure Information
Structure

Compound Identification

SMILES

CC1=[N+](C=C2CN=C(C3=CC=CC=C3F)C3=C(C=CC(Cl)=C3)N12)C1OC(C(O)C(O)C1O)C([O-])=O

InChIKey

InChIKey=ULVPQZCKSQYJQR-UHFFFAOYSA-N

Formula

C24H21ClFN3O6

Mass

501.9

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzodiazepines

Subclass

1,4-benzodiazepines

Intermediate Tree Nodes

Not available

Direct Parent

Imidazo[1,5-a][1,4]benzodiazepines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

N-glucuronide - Imidazo[1,5-a][1,4]benzodiazepine - Glucuronic acid or derivatives - N-glycosyl compound - Glycosyl compound - Para-diazepine - Halobenzene - Fluorobenzene - Beta-hydroxy acid - N-substituted imidazole - Aryl chloride - Hydroxy acid - Aryl fluoride - Oxane - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyran - Azole - Imidazole - Heteroaromatic compound - Secondary alcohol - Ketimine - Carboxylic acid salt - Oxacycle - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Polyol - Monocarboxylic acid or derivatives - Organic zwitterion - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic salt - Carbonyl group - Alcohol - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Imine - Organochloride - Organic nitrogen compound - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as imidazo[1,5-a][1,4]benzodiazepines. These are compounds containing an imidazole ring and a 1,4-benzodiazepine ring system, both sharing one nitrogen atom.

External Descriptors

Not available

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