Compound Identification
SMILES
COC1=CC=C(C=C1)C1CC(=O)C2=C(C1)NC1=CC=CC=C1N(C2C1=CC=C(C=C1)C(C)(C)C)C(=O)CCC(O)=O
InChIKey
InChIKey=BGNYIUFAMQMHFF-UHFFFAOYSA-N
Formula
C34H36N2O5
Mass
552.671
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
Phenylpropanes Phenoxy compounds Methoxybenzenes Anisoles Secondary alkylarylamines 1,4-diazepines Alkyl aryl ethers Cyclohexenones Vinylogous amides Tertiary carboxylic acid amides Amino acids Monocarboxylic acids and derivatives Enamines Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodiazepine - Phenylpropane - Phenoxy compound - Phenol ether - Methoxybenzene - Anisole - Para-diazepine - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Cyclohexenone - Benzenoid - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Vinylogous amide - Ketone - Amino acid or derivatives - Carboxamide group - Amino acid - Monocarboxylic acid or derivatives - Secondary amine - Ether - Enamine - Carboxylic acid - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen 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