Structure Information
Structure

Compound Identification

SMILES

[Cl-].CCOC(=O)c1cccc(c1)[N+]1=C(N)C2N(C(SC2(C)C)C(C)C)C1=O

InChIKey

InChIKey=NZBIQRLMVLIOFQ-UHFFFAOYSA-N

Formula

C19H26ClN3O3S

Mass

411.95

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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

Not available

Direct Parent

Benzoic acid esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzoate ester - Benzoyl - 3-imidazoline - Thiazolidine - Carboxylic acid ester - Urea - Amidine - Carboxylic acid amidine - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Thioether - Hemithioaminal - Azacycle - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Dialkylthioether - Organoheterocyclic compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Amine - Organopnictogen compound - Organic oxide - Organic nitrogen compound - Organic salt - Organonitrogen compound - Organic chloride salt - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.

External Descriptors

Not available

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