Compound Identification
SMILES
[O-][N+](=O)C1=CC=C(OP(=O)(OC2=CC=C(C=C2)[N+]([O-])=O)N(CCCl)CCCl)C=C1
InChIKey
InChIKey=KXDQQHTUGMYWPA-UHFFFAOYSA-N
Formula
C16H16Cl2N3O7P
Mass
464.19
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
Phosphoric diester monoamides Phenoxy compounds Nitrogen mustard compounds Nitroaromatic compounds Organic phosphoramides Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organopnictogen compounds Organooxygen compounds Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Nitrogen mustard - Phosphoric diester monoamide - Organic phosphoric acid derivative - Organic phosphoric acid amide - Phosphoric acid ester - C-nitro compound - Organic nitro compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Alkyl chloride - Organooxygen compound - Organonitrogen compound - Organochloride - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - 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