sodium 3-(3-octoxy-3-oxidanylidene-propyl)sulfanylpropanoate

Systemtic Name: sodium 3-(3-octoxy-3-oxidanylidene-propyl)sulfanylpropanoate Openeye Name: sodium 3-(3-octoxy-3-oxo-propyl)sulfanylpropanoate CAS Name: sodium 3-[(3-octoxy-3-oxopropyl)thio]propanoate IUPAC Name: sodium 3-(3-octoxy-3-oxopropyl)sulfanylpropanoate Traditional Name: sodium 3-[(3-keto-3-octoxy-propyl)thio]propionate Formula: C14H25NaO4S MolecularWeight: 312.40067

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)CCSCCC(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCOC(=O)CCSCCC(=O)[O-].[Na+]

InChI

InChI=1S/C14H26O4S.Na/c1-2-3-4-5-6-7-10-18-14(17)9-12-19-11-8-13(15)16;/h2-12H2,1H3,(H,15,16);/q;+1/p-1