Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(CCC[N+]2(CCCS(O)(=O)=O)CCOCC2)C=C1

InChIKey

InChIKey=QXOSRXFYFZGYNF-UHFFFAOYSA-O

Formula

C17H28NO4S

Mass

342.47

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Phenylpropylamines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpropylamines

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenylpropylamine - Toluene - Aralkylamine - Morpholine - Oxazinane - Quaternary ammonium salt - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Tetraalkylammonium salt - Alkanesulfonic acid - Ether - Dialkyl ether - Organoheterocyclic compound - Azacycle - Oxacycle - Organic nitrogen compound - Amine - Organic oxide - Organic oxygen compound - Organosulfur compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpropylamines. These are compounds containing a phenylpropylamine moiety, which consists of a phenyl group substituted at the third carbon by an propan-1-amine.

External Descriptors

Not available

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