Structure Information
Structure

Compound Identification

SMILES

CN(C)C1CS(=O)(=O)OC(=C1)C1=CC=CC=C1

InChIKey

InChIKey=NBTQMOIUYUHZKF-UHFFFAOYSA-N

Formula

C12H15NO3S

Mass

253.32

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Oxathiins

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Oxathiins

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Monocyclic benzene moiety - 1,2-oxathiin - Sulfonic acid ester - Benzenoid - Organosulfonic acid ester - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Oxacycle - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as oxathiins. These are compounds containing an oxathiin moiety, which consists of an unsaturated aliphatic six-member ring with one oxygen atom, a sulfur atom, and four carbon atoms. Isomers of oxaphospholane include 1,2-oxathiin, 1,3-oxathiin,and 1,4-oxathiin.

External Descriptors

Not available

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