Structure Information
Structure

Compound Identification

SMILES

COC(=O)COC1=CC=C(C=C1)C(O)CNC(=O)C1=NC=C(C=C1)C#N

InChIKey

InChIKey=IOYYIHGHRAXHBC-UHFFFAOYSA-N

Formula

C18H17N3O5

Mass

355.35

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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 heteromonocyclic compounds

Substituents

Phenoxyacetate - Pyridine carboxylic acid or derivatives - 2-heteroaryl carboxamide - Phenoxy compound - Phenol ether - 3-pyridinecarbonitrile - Alkyl aryl ether - Pyridine - Methyl ester - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Alcohol - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Aromatic alcohol - Carbonyl group - Organic nitrogen compound - Aromatic heteromonocyclic 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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