Compound Identification
SMILES
CCCNC(=O)N1[C@@H](C2=CC=CC=C2OC)C2=C(C[C@H](CC2=O)C2=CC=CO2)NC2=CC=CC=C12
InChIKey
InChIKey=CPBMROYYKZBPEP-CLYVBNDRSA-N
Formula
C28H29N3O4
Mass
471.557
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
Anisoles Methoxybenzenes Phenoxy compounds 1,4-diazepines Alkyl aryl ethers Cyclohexenones Secondary alkylarylamines Heteroaromatic compounds Furans Vinylogous amides Ureas Enamines Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodiazepine - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Para-diazepine - Alkyl aryl ether - Cyclohexenone - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Furan - Vinylogous amide - Urea - Ketone - Oxacycle - Enamine - Ether - Azacycle - Secondary amine - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxide - Organonitrogen compound - Organooxygen 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