Compound Identification
SMILES
COC1=CC(=CC(OC)=C1OC)C(=O)N1C(C2=CC=C(F)C=C2)C2=C(CC(CC2=O)C2=CC=C(C=C2)C(C)(C)C)NC2=CC=CC=C12
InChIKey
InChIKey=BGHHKUPZFVNSFJ-UHFFFAOYSA-N
Formula
C39H39FN2O5
Mass
634.748
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
Benzamides Phenylpropanes Anisoles Benzoyl derivatives Phenoxy compounds Methoxybenzenes 1,4-diazepines Alkyl aryl ethers Secondary alkylarylamines Cyclohexenones Fluorobenzenes Aryl fluorides Vinylogous amides Tertiary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Enamines Hydrocarbon derivatives Organofluorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodiazepine - Benzamide - Benzoic acid or derivatives - Phenylpropane - Phenoxy compound - Anisole - Methoxybenzene - Benzoyl - Phenol ether - Para-diazepine - Alkyl aryl ether - Cyclohexenone - Fluorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Tertiary carboxylic acid amide - Ketone - Amino acid or derivatives - Carboxamide group - Azacycle - Secondary amine - Ether - Enamine - Carboxylic acid derivative - Organooxygen compound - Amine - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organofluoride - Carbonyl group - Organohalogen compound - Organic oxide - 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