Structure Information
Structure

Compound Identification

SMILES

CN1\C(OC2=CC=CC=C12)=C/C(/C)=C1\OC(=S)N(CCCS(O)(=O)=O)C1=O

InChIKey

InChIKey=QUHCRSBMZCUCMH-AIWUCEOPSA-N

Formula

C17H18N2O6S2

Mass

410.46

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzoxazolines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzoxazolines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzoxazoline - Oxazolidinone - Benzenoid - Oxazolidine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Thiocarbamic acid ester - Alkanesulfonic acid - Ketene acetal or derivatives - Thiocarbamic acid derivative - Amino acid or derivatives - Tertiary amine - Azacycle - Oxacycle - Carboxylic acid derivative - Organic oxygen compound - Amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzoxazolines. These are organic compounds containing a benzene ring fused to an oxazoline ring. Oxazoline is five-membered unsaturated ring with a nitrogen atom and an oxygen atom at the 1- and 3-position, respectively. Additionally, it contains two double bonds.

External Descriptors

Not available

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