Compound Identification
SMILES
COC1=CC=C(C=C1)[C@H]1CC(=O)C2=C(C1)NC1=CC=CC=C1N[C@@H]2C1=COC2=C(Cl)C=C(Cl)C=C2C1=O
InChIKey
InChIKey=NYBVZQLZJCWAEK-CHAGWJKLSA-N
Formula
C29H22Cl2N2O4
Mass
533.41
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
Chromones Phenoxy compounds Anisoles Methoxybenzenes 1,4-diazepines Secondary alkylarylamines Pyranones and derivatives Alkyl aryl ethers Aralkylamines Cyclohexenones Aryl chlorides Vinylogous amides Heteroaromatic compounds Azacyclic compounds Oxacyclic compounds Enamines Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodiazepine - Chromone - Benzopyran - 1-benzopyran - Anisole - Phenoxy compound - Phenol ether - Methoxybenzene - Cyclohexenone - Para-diazepine - Aralkylamine - Alkyl aryl ether - Pyranone - Secondary aliphatic/aromatic amine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyran - Heteroaromatic compound - Vinylogous amide - Ketone - Secondary amine - Oxacycle - Azacycle - Enamine - Ether - Carbonyl group - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Amine - Organochloride - Organohalogen compound - 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