Structure Information
Structure

Compound Identification

SMILES

[OH-].OS(=O)(=O)CCC[N+]1=CC2=CC=CC=C2C=C1

InChIKey

InChIKey=ZMEIEJHEHPRCGT-UHFFFAOYSA-N

Formula

C12H15NO4S

Mass

269.32

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Isoquinolines and derivatives

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Isoquinolines and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isoquinoline - Pyridine - Pyridinium - Benzenoid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - Heteroaromatic compound - Azacycle - Organonitrogen compound - Organic hydroxide - Organic nitrogen compound - Organic oxide - Organosulfur compound - Hydrocarbon derivative - Organic salt - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isoquinolines and derivatives. These are aromatic polycyclic compounds containing an isoquinoline moiety, which consists of a benzene ring fused to a pyridine ring and forming benzo[c]pyridine.

External Descriptors

Not available

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