sodium nonyl phenylmethanesulfonate

Systemtic Name: sodium nonyl phenylmethanesulfonate Openeye Name: sodium nonyl phenylmethanesulfonate CAS Name: sodium phenylmethanesulfonic acid nonyl ester IUPAC Name: sodium nonyl phenylmethanesulfonate Traditional Name: sodium phenylmethanesulfonic acid nonyl ester Formula: C16H26NaO3S+ MolecularWeight: 321.43061

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOS(=O)(=O)CC1=CC=CC=C1.[Na+]

Isomeric SMILES

CCCCCCCCCOS(=O)(=O)CC1=CC=CC=C1.[Na+]

InChI

InChI=1S/C16H26O3S.Na/c1-2-3-4-5-6-7-11-14-19-20(17,18)15-16-12-9-8-10-13-16;/h8-10,12-13H,2-7,11,14-15H2,1H3;/q;+1