sodium 15-methyl-1-oxidanyl-3-oxidanylidene-hexadecane-1-sulfonate

Systemtic Name: sodium 15-methyl-1-oxidanyl-3-oxidanylidene-hexadecane-1-sulfonate Openeye Name: sodium 1-hydroxy-15-methyl-3-oxo-hexadecane-1-sulfonate CAS Name: sodium 1-hydroxy-15-methyl-3-oxo-1-hexadecanesulfonate IUPAC Name: sodium 1-hydroxy-15-methyl-3-oxohexadecane-1-sulfonate Traditional Name: sodium 1-hydroxy-3-keto-15-methyl-hexadecane-1-sulfonate Formula: C17H33NaO5S MolecularWeight: 372.49569

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCC(=O)CC(O)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC(C)CCCCCCCCCCCC(=O)CC(O)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C17H34O5S.Na/c1-15(2)12-10-8-6-4-3-5-7-9-11-13-16(18)14-17(19)23(20,21)22;/h15,17,19H,3-14H2,1-2H3,(H,20,21,22);/q;+1/p-1