Compound Identification
SMILES
[O-][N+](=O)C1=CC=C(CN2CCN=C(\C=C\C3=CC(Cl)=C(Cl)C=C3)C3=CC=CC=C23)C=C1
InChIKey
InChIKey=TYTMAUQKVQNEEY-XYOKQWHBSA-N
Formula
C24H19Cl2N3O2
Mass
452.34
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
Nitrobenzenes Benzylamines Dialkylarylamines Dichlorobenzenes Nitroaromatic compounds Styrenes Phenylmethylamines Aralkylamines Aryl chlorides Ketimines Organic oxoazanium compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Organic oxides Organic salts Organochlorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Nitrobenzene - Benzylamine - Nitroaromatic compound - 1,2-dichlorobenzene - Phenylmethylamine - Styrene - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Chlorobenzene - Halobenzene - Aralkylamine - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Tertiary amine - Organic nitro compound - Ketimine - C-nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organic 1,3-dipolar compound - Organic oxoazanium - Organic salt - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Imine - Organic oxygen compound - Amine - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organic cation - 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