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methylidyne-[6-(5-oxidanyl-5-oxidanylidene-pentyl)sulfanylhexyl]azanium

methylidyne-[6-(5-oxidanyl-5-oxidanylidene-pentyl)sulfanylhexyl]azanium

Systemtic Name:methylidyne-[6-(5-oxidanyl-5-oxidanylidene-pentyl)sulfanylhexyl]azanium
Openeye Name:6-(5-hydroxy-5-oxo-pentyl)sulfanylhexyl-methylidyne-ammonium
CAS Name:6-[(5-hydroxy-5-oxopentyl)thio]hexyl-methylidyneammonium
IUPAC Name:6-(5-hydroxy-5-oxopentyl)sulfanylhexyl-methylidyneazanium
Traditional Name:6-[(5-hydroxy-5-keto-pentyl)thio]hexyl-methylidyne-ammonium
Formula: C12H22NO2S+
MolecularWeight: 244.37358
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Descriptors Computed from Structure

Canonical SMILES:

C#[N+]CCCCCCSCCCCC(=O)O


Isomeric SMILES

C#[N+]CCCCCCSCCCCC(=O)O


InChI

InChI=1S/C12H21NO2S/c1-13-9-5-2-3-6-10-16-11-7-4-8-12(14)15/h1H,2-11H2/p+1


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