Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C(OC)(OC1=CC2=NC=NC=C2C=C1)N1CCC2=C1C=C(Cl)C=C2

InChIKey

InChIKey=IYHQFCLAPOVQCJ-UHFFFAOYSA-N

Formula

C21H20ClN3O4

Mass

413.86

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Phenoxyacetic acid derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Phenoxyacetic acid derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenoxyacetate - Alpha-amino acid or derivatives - Quinazoline - Indole or derivatives - Dialkylarylamine - Phenol ether - Aryl chloride - Aryl halide - Amide acetal - Pyrimidine - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid ester - Tertiary amine - Orthocarboxylic acid derivative - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organooxygen compound - Organic oxygen compound - Amine - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenoxyacetic acid derivatives. These are compounds containing an anisole where the methane group is linked to an acetic acid or a derivative.

External Descriptors

Not available

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