Structure Information
Structure

Compound Identification

SMILES

COC1=CC(=CC(CCCC[NH3+])=C2ONC(=N2)C2=CC=CS2)C=C(Cl)C1=O

InChIKey

InChIKey=KWTSORZTWKFOHK-UHFFFAOYSA-O

Formula

C19H21ClN3O3S

Mass

406.9

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Cyclic ketones - Quinomethanes

Direct Parent

P-quinomethanes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

P-quinomethane - Imidolactam - Alpha-haloketone - Alpha-chloroketone - Quaternary ammonium salt - Heteroaromatic compound - Thiophene - Ketene acetal or derivatives - Amidine - Oxacycle - Vinyl chloride - Vinyl halide - Azacycle - Organoheterocyclic compound - Haloalkene - Chloroalkene - Hydrocarbon derivative - Primary amine - Organic oxide - Amine - Organic nitrogen compound - Primary aliphatic amine - Organohalogen compound - Organochloride - Organonitrogen compound - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as p-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 4, respectively.

External Descriptors

Not available

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