Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(C)NC(C)=C([C@@H]1C)[S@@](=O)C1=CC=C(C)C=C1

InChIKey

InChIKey=MXKSSTBNCFLAQR-XFNZEKPQSA-N

Formula

C17H21NO3S

Mass

319.42

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyridines and derivatives

Subclass

Hydropyridines

Intermediate Tree Nodes

Dihydropyridines

Direct Parent

Dihydropyridinecarboxylic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenyl sulfoxide - Dihydropyridinecarboxylic acid derivative - Toluene - Monocyclic benzene moiety - Benzenoid - Methyl ester - Enoate ester - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Sulfoxide - Sulfinyl compound - Monocarboxylic acid or derivatives - Enamine - Secondary aliphatic amine - Carboxylic acid derivative - Azacycle - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as dihydropyridinecarboxylic acids and derivatives. These are compounds containing a dihydropyridine moiety bearing a carboxylic acid group.

External Descriptors

Not available

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