Compound Identification
SMILES
CC1(C)CC(=O)[C@H]2[C@@H](N(C(=O)CC3=CC=C(Cl)C=C3)C3=CC=CC=C3N=C2C1)C1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=QYWPVWDCWBKTCV-NSOVKSMOSA-N
Formula
C29H26ClN3O4
Mass
515.99
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzodiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodiazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzodiazepines
Alternative Parents
Phenylacetamides Nitrobenzenes Nitroaromatic compounds 1,4-diazepines Chlorobenzenes Aryl chlorides Tertiary carboxylic acid amides Tertiary amines Ketones Ketimines Amino acids and derivatives Organic oxoazanium compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodiazepine - Phenylacetamide - Nitrobenzene - Nitroaromatic compound - Para-diazepine - Halobenzene - Chlorobenzene - Aryl chloride - Benzenoid - Aryl halide - Monocyclic benzene moiety - Tertiary carboxylic acid amide - C-nitro compound - Ketimine - Amino acid or derivatives - Ketone - Tertiary amine - Carboxamide group - Organic nitro compound - Azacycle - Organic 1,3-dipolar compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Imine - Organic oxide - Organic oxygen compound - Amine - Carbonyl group - Organic salt - Organic nitrogen compound - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzodiazepines. These are organic compounds containing a benzene ring fused to either isomers of diazepine(unsaturated seven-member heterocycle with two nitrogen atoms replacing two carbon atoms).
External Descriptors
Not available