sodium 1-phenyldodecane-1-sulfonate

Systemtic Name: sodium 1-phenyldodecane-1-sulfonate Openeye Name: sodium 1-phenyldodecane-1-sulfonate CAS Name: sodium 1-phenyl-1-dodecanesulfonate IUPAC Name: sodium 1-phenyldodecane-1-sulfonate Traditional Name: sodium 1-phenyldodecane-1-sulfonate Formula: C18H29NaO3S MolecularWeight: 348.47583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(C1=CC=CC=C1)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCCCC(C1=CC=CC=C1)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C18H30O3S.Na/c1-2-3-4-5-6-7-8-9-13-16-18(22(19,20)21)17-14-11-10-12-15-17;/h10-12,14-15,18H,2-9,13,16H2,1H3,(H,19,20,21);/q;+1/p-1