Compound Identification
SMILES
[Cl-].C[N+](CCCl)(CCCl)CC1=CC(=CC=C1)[N+]([O-])=O
InChIKey
InChIKey=SJAYGGZNWCFUDV-UHFFFAOYSA-M
Formula
C12H17Cl3N2O2
Mass
327.63
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Nitrobenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Nitrobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitrobenzenes
Alternative Parents
Phenylmethylamines Nitrogen mustard compounds Nitroaromatic compounds Benzylamines Aralkylamines Tetraalkylammonium salts Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organopnictogen compounds Organochlorides Organic oxides Organic chloride salts Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Nitrobenzene - Benzylamine - Nitroaromatic compound - Nitrogen mustard - Phenylmethylamine - Aralkylamine - Tetraalkylammonium salt - Quaternary ammonium salt - C-nitro compound - Organic nitro compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic chloride salt - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Alkyl chloride - Organohalogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Amine - Organic salt - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.
External Descriptors
Not available