Structure Information
Structure

Compound Identification

SMILES

CC1(C)OCC(CCC2=CC=CC=C2)N1\C([O-])=C(/[N+]#N)S(=O)(=O)C1=CC=CC=C1

InChIKey

InChIKey=VJVSTPNDSRKRLQ-VXPUYCOJSA-N

Formula

C21H23N3O4S

Mass

413.49

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzenesulfonyl compounds

Intermediate Tree Nodes

Not available

Direct Parent

Benzenesulfonyl compounds

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzenesulfonyl group - Oxazolidine - Sulfone - Sulfonyl - Organoheterocyclic compound - Oxacycle - Azacycle - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic salt - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organosulfur compound - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzenesulfonyl compounds. These are aromatic compounds containing a benzenesulfonyl group, which consists of a monocyclic benzene moiety that carries a sulfonyl group.

External Descriptors

Not available

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