sodium 1-(4-methylphenyl)nonane-1-sulfonate

Systemtic Name: sodium 1-(4-methylphenyl)nonane-1-sulfonate Openeye Name: sodium 1-(p-tolyl)nonane-1-sulfonate CAS Name: sodium 1-(4-methylphenyl)-1-nonanesulfonate IUPAC Name: sodium 1-(4-methylphenyl)nonane-1-sulfonate Traditional Name: sodium 1-(p-tolyl)nonane-1-sulfonate Formula: C16H25NaO3S MolecularWeight: 320.42267

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26O3S.Na/c1-3-4-5-6-7-8-9-16(20(17,18)19)15-12-10-14(2)11-13-15;/h10-13,16H,3-9H2,1-2H3,(H,17,18,19);/q;+1/p-1