Compound Identification
SMILES
CCCCCC(=O)N1C(C2=CC=C(C=C2)C(=O)OC)C2=C(CC(CC2=O)C2=CC=CC=C2)NC2=CC=CC=C12
InChIKey
InChIKey=MHKQWMZHLPKYJF-UHFFFAOYSA-N
Formula
C33H34N2O4
Mass
522.645
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
Benzoic acid esters Benzoyl derivatives Secondary alkylarylamines Cyclohexenones 1,4-diazepines Vinylogous amides Tertiary carboxylic acid amides Methyl esters Amino acids and derivatives Enamines Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodiazepine - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Para-diazepine - Cyclohexenone - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Vinylogous amide - Methyl ester - Amino acid or derivatives - Ketone - Carboxylic acid ester - Carboxamide group - Secondary amine - Enamine - Carboxylic acid derivative - Azacycle - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - 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