Compound Identification
SMILES
[O-][N+](=O)C1=C(NCC2=C(Cl)C=CC=C2Cl)C=C(Cl)C=C1
InChIKey
InChIKey=MGDBFQRTVJRHIX-UHFFFAOYSA-N
Formula
C13H9Cl3N2O2
Mass
331.58
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Phenylmethylamines
- Level 5 Phenylbenzamines
-
Subclass
Phenylmethylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbenzamines
Alternative Parents
Nitrobenzenes Phenylalkylamines Nitroaromatic compounds Dichlorobenzenes Benzylamines Aniline and substituted anilines Secondary alkylarylamines Aryl chlorides Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organochlorides Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylbenzamine - Nitrobenzene - Benzylamine - Nitroaromatic compound - 1,3-dichlorobenzene - Aniline or substituted anilines - Phenylalkylamine - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Aralkylamine - Aryl chloride - Aryl halide - Organic nitro compound - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Organic oxoazanium - Organic zwitterion - Organohalogen compound - Organic oxide - Organochloride - Organic oxygen compound - Amine - Organic nitrogen compound - Organic salt - Organonitrogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbenzamines. These are aromatic compounds consisting of a benzyl group that is N-linked to a benzamine.
External Descriptors
Not available