Structure Information
Structure

Compound Identification

SMILES

[I-].[O-]S(=O)(=O)C(F)(F)F.NC(=O)C[N+]12CC[N+](CCC3=C4C=CC=C5NS(=O)(=O)C(C=C3)=C45)(CC1)CC2

InChIKey

InChIKey=OQHHQSQYAPFBHK-UHFFFAOYSA-M

Formula

C21H26F3IN4O6S2

Mass

678.48

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Naphthalenes

Subclass

Naphthalene sulfonic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

1-naphthalene sulfonic acids and derivatives

Alternative Parents

Molecular Framework

Not available

Substituents

1-naphthalene sulfonamide - Naphthalene sulfonamide - 1-naphthalene sulfonic acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - N-piperazineacetamide - 1,2-benzothiazole - Phenethylamine - Trifluoromethanesulfonate - N-alkylpiperazine - Aralkylamine - 1,4-diazinane - Piperazine - Organosulfonic acid amide - Tetraalkylammonium salt - Methanesulfonate - Quaternary ammonium salt - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - Carboxamide group - Primary carboxylic acid amide - Trihalomethane - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Organic zwitterion - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Halomethane - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Organic iodide salt - Amine - Organic salt - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-naphthalene sulfonic acids and derivatives. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group (or a derivative thereof) at the 1-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.

External Descriptors

Not available

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