Compound Identification
SMILES
OO[C@@H]1C[C@H](O[P+]([O-])(N1)N(CCCl)CCCl)C1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=BGGYWYCBMPZTJJ-HKFILKPHSA-N
Formula
C13H18Cl2N3O6P
Mass
414.18
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
Nitrogen mustard compounds Nitroaromatic compounds Oxazaphosphinanes Propargyl-type 1,3-dipolar organic compounds Peroxols Oxacyclic compounds Organic oxoazanium compounds Azacyclic compounds Alkyl hydroperoxides Organochlorides Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzene - Nitroaromatic compound - Nitrogen mustard - Oxazaphosphinane - C-nitro compound - Hydroperoxide - Organic nitro compound - Alkyl hydroperoxide - Organic oxoazanium - Peroxol - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Oxacycle - Azacycle - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organic zwitterion - Organic nitrogen compound - Organic oxygen compound - Alkyl chloride - Organic salt - Organohalogen compound - Organic oxide - Alkyl halide - Aromatic heteromonocyclic 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