Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC(NC(=S)N2CCCCC2CO)=C(C=C1)C(=O)OC

InChIKey

InChIKey=LUKWGZBABTUCLF-UHFFFAOYSA-N

Formula

C17H22N2O5S

Mass

366.43

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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 - N-phenylthiourea - Benzoyl - Piperidine - Methyl ester - Vinylogous amide - Carboxylic acid ester - Thiourea - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Primary alcohol - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Alcohol - Organic oxygen compound - Organic nitrogen compound - 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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