Compound Identification
SMILES
CCOC1=C(O)C(Br)=CC(=C1)C1NC2=CC=CC=C2NC2=C1C(=O)CC(C2)C1=CC(OC)=C(OC)C(OC)=C1
InChIKey
InChIKey=IWQDSHGMTYGVIG-UHFFFAOYSA-N
Formula
C30H31BrN2O6
Mass
595.49
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 O-bromophenols Methoxybenzenes Anisoles Secondary alkylarylamines 1,4-diazepines Alkyl aryl ethers Aralkylamines Cyclohexenones Bromobenzenes Aryl bromides Vinylogous amides Enamines Azacyclic compounds Hydrocarbon derivatives Organobromides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodiazepine - Anisole - Phenoxy compound - 2-halophenol - 2-bromophenol - Phenol ether - Methoxybenzene - Para-diazepine - Alkyl aryl ether - Bromobenzene - Halobenzene - Cyclohexenone - Phenol - Secondary aliphatic/aromatic amine - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Aryl halide - Aryl bromide - Vinylogous amide - Ketone - Ether - Enamine - Secondary amine - Azacycle - Organic oxide - Organic nitrogen compound - Carbonyl group - Amine - Organic oxygen compound - Hydrocarbon derivative - Organohalogen compound - Organobromide - 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