Compound Identification
SMILES
COC(=O)C1=C(OC)C=C2CN=C(C3=CC=CC=C3F)C3=C(C=CC(Cl)=C3)N2C1=O
InChIKey
InChIKey=FRGLJLIEIRXHHC-UHFFFAOYSA-N
Formula
C22H16ClFN2O4
Mass
426.83
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzodiazepines
- Subclass 1,4-benzodiazepines
-
Class
Benzodiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodiazepines
Subclass
1,4-benzodiazepines
Intermediate Tree Nodes
Not available
Direct Parent
1,4-benzodiazepines
Alternative Parents
Pyridodiazepines Pyridinecarboxylic acids Alkyl aryl ethers Pyridinones Fluorobenzenes Aryl chlorides Aryl fluorides Vinylogous esters Vinylogous amides Heteroaromatic compounds Methyl esters Ketimines Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Hydrocarbon derivatives Organofluorides Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrido-para-diazepine - 1,4-benzodiazepine - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Alkyl aryl ether - Halobenzene - Pyridinone - Fluorobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Pyridine - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Methyl ester - Vinylogous ester - Vinylogous amide - Lactam - Ketimine - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organic 1,3-dipolar compound - Ether - Propargyl-type 1,3-dipolar organic compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Imine - Organonitrogen compound - Organofluoride - Organohalogen compound - Organochloride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,4-benzodiazepines. These are organic compounds containing a benzene ring fused to a 1,4-azepine.
External Descriptors
Not available