Compound Identification
SMILES
COC1=CC=C(C=C1)[C@H]1CC(=O)C2=C(C1)NC1=CC=CC=C1N[C@@H]2C1=C(Cl)C=CC=C1Cl
InChIKey
InChIKey=XHVLEHMTUKFUMG-AKJBCIBTSA-N
Formula
C26H22Cl2N2O2
Mass
465.37
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
Phenoxy compounds Methoxybenzenes Anisoles Dichlorobenzenes Secondary alkylarylamines 1,4-diazepines Alkyl aryl ethers Aralkylamines Cyclohexenones Aryl chlorides Vinylogous amides Enamines Azacyclic compounds Hydrocarbon derivatives Organochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodiazepine - Anisole - Phenoxy compound - 1,3-dichlorobenzene - Phenol ether - Methoxybenzene - Para-diazepine - Alkyl aryl ether - Chlorobenzene - Halobenzene - Cyclohexenone - Secondary aliphatic/aromatic amine - Aralkylamine - Aryl halide - Benzenoid - Aryl chloride - Monocyclic benzene moiety - Vinylogous amide - Ketone - Azacycle - Secondary amine - Enamine - Ether - Amine - Carbonyl group - Organic oxygen compound - Organohalogen compound - Organochloride - Hydrocarbon derivative - Organonitrogen compound - Organic oxide - Organooxygen compound - Organic nitrogen 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