sodium 1-(2-sulfonatosulfanylethylsulfonyl)heptane

Systemtic Name: sodium 1-(2-sulfonatosulfanylethylsulfonyl)heptane Openeye Name: sodium 1-(2-sulfonatosulfanylethylsulfonyl)heptane CAS Name: sodium 1-[2-(sulfonatothio)ethylsulfonyl]heptane IUPAC Name: sodium 1-(2-sulfonatosulfanylethylsulfonyl)heptane Traditional Name: sodium 1-[2-(sulfonatothio)ethylsulfonyl]heptane Formula: C9H19NaO5S3 MolecularWeight: 326.42893

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCS(=O)(=O)CCSS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCS(=O)(=O)CCSS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C9H20O5S3.Na/c1-2-3-4-5-6-8-16(10,11)9-7-15-17(12,13)14;/h2-9H2,1H3,(H,12,13,14);/q;+1/p-1