Compound Identification
SMILES
CN(C)C1=CC=C(C=C1)C1N(C(=O)CCC([O-])=O)C2=CC=CC=C2NC2=C1C(=O)CC(C2)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=UGZFCRYLVXODPS-UHFFFAOYSA-M
Formula
C31H29ClN3O4
Mass
543.04
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
Aniline and substituted anilines Dialkylarylamines Secondary alkylarylamines 1,4-diazepines Chlorobenzenes Cyclohexenones Aryl chlorides Vinylogous amides Tertiary carboxylic acid amides Amino acids Carboxylic acid salts Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Enamines Organic oxides Hydrocarbon derivatives Organochlorides Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodiazepine - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Para-diazepine - Cyclohexenone - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Tertiary carboxylic acid amide - Amino acid or derivatives - Amino acid - Carboxamide group - Carboxylic acid salt - Ketone - Tertiary amine - Monocarboxylic acid or derivatives - Secondary amine - Carboxylic acid derivative - Enamine - Azacycle - Carboxylic acid - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Amine - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic anion - 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