Structure Information
Structure

Compound Identification

SMILES

[O-]S(=O)(=O)C1=CC=CC=C1.N#CC[N+]1(CC2=CC=CC=N2)CCCC1

InChIKey

InChIKey=OJPUAKBCOCCESD-UHFFFAOYSA-M

Formula

C18H21N3O3S

Mass

359.44

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzenesulfonic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Benzenesulfonic acids and derivatives

Alternative Parents

Molecular Framework

Not available

Substituents

Benzenesulfonate - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Benzenesulfonyl group - 2-pyridylmethylamine - Aralkylamine - Pyridine - N-alkylpyrrolidine - Tetraalkylammonium salt - Heteroaromatic compound - Pyrrolidine - Quaternary ammonium salt - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Alpha-aminonitrile - Azacycle - Organoheterocyclic compound - Carbonitrile - Nitrile - Organic oxide - Organic oxygen compound - Cyanide - Amine - Organosulfur compound - Organonitrogen compound - Organic zwitterion - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzenesulfonic acids and derivatives. These are organic compounds containing a sulfonic acid or a derivative thereof that is linked to a benzene ring.

External Descriptors

Not available

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