Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(O)C2=NC=C(CC3=CC=C(F)C=C3)C=C2C(=C1)C(O)=O

InChIKey

InChIKey=KLPDVDQBLIFIEX-UHFFFAOYSA-N

Formula

C19H14FNO5

Mass

355.321

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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

Quinoline-5-carboxylic acid - Meta-phthalic acid ester - Meta_phthalic_acid - 8-hydroxyquinoline - Hydroxybenzoic acid - Quinoline - Salicylic acid or derivatives - Fluorobenzene - Halobenzene - Phenol - Pyridine - Aryl halide - Aryl fluoride - Methyl ester - Heteroaromatic compound - Vinylogous acid - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - 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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