Compound Identification
SMILES
CC1=CC(=C(C[N+](C)(CCCl)CCCl)C=C1)[N+]([O-])=O
InChIKey
InChIKey=OOKAMXJWIPWPQB-UHFFFAOYSA-N
Formula
C13H19Cl2N2O2
Mass
306.21
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
Nitrotoluenes Phenylmethylamines Nitrogen mustard compounds Nitroaromatic compounds Benzylamines Aralkylamines Tetraalkylammonium salts Organic oxoazanium compounds Organopnictogen compounds Organochlorides Organic salts Organic oxides Hydrocarbon derivatives Alkyl chlorides Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Nitrobenzene - Nitrotoluene - Benzylamine - Nitroaromatic compound - Nitrogen mustard - Phenylmethylamine - Toluene - Aralkylamine - Quaternary ammonium salt - Tetraalkylammonium salt - Organic nitro compound - C-nitro compound - Organic oxoazanium - Organic salt - Hydrocarbon derivative - Alkyl chloride - Organic oxide - Organonitrogen compound - Organochloride - Alkyl halide - Organohalogen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Organic cation - 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