Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC=C(C=C1)C(=O)OCCN1C(C)=NC=C1[N+]([O-])=O

InChIKey

InChIKey=OKZGYSZBFJKADZ-UHFFFAOYSA-N

Formula

C15H15N3O6

Mass

333.3

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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

p-Phthalate esters

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Para-phthalic acid ester - Para_phthalic_acid - Benzoate ester - 1,2,5-trisubstituted-imidazole - Nitroaromatic compound - Benzoyl - Nitroimidazole - Trisubstituted imidazole - N-substituted imidazole - Azole - Imidazole - Heteroaromatic compound - Methyl ester - Organic nitro compound - Carboxylic acid ester - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Organic 1,3-dipolar compound - Azacycle - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic oxoazanium - Organic salt - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Organooxygen compound - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as p-phthalate esters. These are ester derivatives of p-phthalic acids, which are based on a benzene 1,4-dicarboxylic acid skeleton.

External Descriptors

Not available

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