Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=CC(NC(C2=CC=C(C=C2)N(CCCl)CCCl)P(=O)(OC2=CC=CC=C2)OC2=CC=CC=C2)=C1

InChIKey

InChIKey=ISRWDFHEPRJBBM-UHFFFAOYSA-N

Formula

C29H28Cl2N3O5P

Mass

600.43

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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 - Nitrogen mustard - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Phenylalkylamine - Nitroaromatic compound - Phenoxy compound - Phosphonic acid diester - Secondary aliphatic/aromatic amine - Phosphonic acid ester - Organophosphonic acid derivative - C-nitro compound - Organic nitro compound - Tertiary amine - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Alkyl chloride - Alkyl halide - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organic zwitterion - Amine - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - 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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