Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(N)C=C(C2=C1COC2=O)C1=CC(=CC=C1)[N+]([O-])=O

InChIKey

InChIKey=YSITWVGYRYJRJK-UHFFFAOYSA-N

Formula

C17H14N2O6

Mass

342.307

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Phthalic acid and derivatives - Phthalate esters

Direct Parent

m-Phthalate esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Meta-phthalic acid ester - Meta_phthalic_acid - Phthalide - Isobenzofuranone - Nitrobenzene - Isocoumaran - Nitroaromatic compound - Vinylogous amide - Amino acid or derivatives - Carboxylic acid ester - Lactone - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxoazanium - Amine - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Organic salt - Hydrocarbon derivative - Primary amine - Organic zwitterion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as m-phthalate esters. These are ester derivatives of m-phthalic acids, which are based on a benzene 1,3-dicarboxylic acid skeleton.

External Descriptors

Not available

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