Compound Identification
SMILES
CC(C)(C)C1=CC=C(C=C1)[C@H]1CC(=O)C2=C(C1)NC1=CC=CC=C1N([C@H]2C1=CC=NC=C1)C(=O)CCC([O-])=O
InChIKey
InChIKey=ONZSTRMVESGJJF-UVDDSOTQSA-M
Formula
C32H32N3O4
Mass
522.626
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
Phenylpropanes Secondary alkylarylamines 1,4-diazepines Cyclohexenones Pyridines and derivatives Vinylogous amides Tertiary carboxylic acid amides Heteroaromatic compounds Amino acids Carboxylic acid salts Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Enamines Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodiazepine - Phenylpropane - Para-diazepine - Cyclohexenone - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Pyridine - Heteroaromatic compound - Vinylogous amide - Tertiary carboxylic acid amide - Amino acid or derivatives - Amino acid - Carboxamide group - Carboxylic acid salt - Ketone - Azacycle - Carboxylic acid derivative - Carboxylic acid - Enamine - Secondary amine - Monocarboxylic acid or derivatives - Amine - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - 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