Structure Information
Structure

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

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Nitrobenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Nitrobenzenes

Alternative Parents

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

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