Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=C(OC(=O)COP(=O)(OCC(=O)OC2=CC=C(C=C2)[N+]([O-])=O)OC2=CC=C(C=C2)[N+]([O-])=O)C=C1

InChIKey

InChIKey=BVMUFPKIAHUIQI-UHFFFAOYSA-N

Formula

C22H16N3O14P

Mass

577.351

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenol esters

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Phenol esters

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Phenol ester - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Dialkyl phosphate - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Organic phosphoric acid derivative - Phosphoric acid ester - Alkyl phosphate - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Organic oxoazanium - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Organic oxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenol esters. These are aromatic compounds containing a benzene ring substituted by a hydroxyl group and an ester group.

External Descriptors

Not available

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