Compound Identification
SMILES
CCCCOC1=CC=CC=C1[C@H]1NC2=CC=CC=C2NC2=C1C(=O)C[C@@H](C2)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=MKAKNNQSPBLZHN-ACSYHNTCSA-N
Formula
C29H29ClN2O2
Mass
473.01
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 Phenol ethers Secondary alkylarylamines Cyclohexenones Chlorobenzenes Aralkylamines Alkyl aryl ethers 1,4-diazepines Aryl chlorides Vinylogous amides Enamines Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodiazepine - Phenoxy compound - Phenol ether - Para-diazepine - Alkyl aryl ether - Cyclohexenone - Aralkylamine - Chlorobenzene - Secondary aliphatic/aromatic amine - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Ketone - Ether - Enamine - Secondary amine - Azacycle - Organochloride - Organohalogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Organonitrogen 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