sodium 4-(decyldisulfanyl)butane-1-sulfinate hydrate

Systemtic Name: sodium 4-(decyldisulfanyl)butane-1-sulfinate hydrate Openeye Name: sodium 4-(decyldisulfanyl)butane-1-sulfinate hydrate CAS Name: sodium 4-(decyldisulfanyl)-1-butanesulfinate hydrate IUPAC Name: sodium 4-(decyldisulfanyl)butane-1-sulfinate hydrate Traditional Name: sodium 4-(decyldisulfanyl)butane-1-sulfinate hydrate Formula: C14H31NaO3S3 MolecularWeight: 366.57891

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSSCCCCS(=O)[O-].O.[Na+]

Isomeric SMILES

CCCCCCCCCCSSCCCCS(=O)[O-].O.[Na+]

InChI

InChI=1S/C14H30O2S3.Na.H2O/c1-2-3-4-5-6-7-8-9-12-17-18-13-10-11-14-19(15)16;;/h2-14H2,1H3,(H,15,16);;1H2/q;+1;/p-1