barium(2+); 2,3-di(nonyl)naphthalene-1-sulfonate

Systemtic Name: barium(2+); 2,3-di(nonyl)naphthalene-1-sulfonate Openeye Name: barium(2+); 2,3-di(nonyl)naphthalene-1-sulfonate CAS Name: barium(2+); 2,3-di(nonyl)-1-naphthalenesulfonate IUPAC Name: barium(2+); 2,3-di(nonyl)naphthalene-1-sulfonate Traditional Name: barium(2+); 2,3-di(nonyl)naphthalene-1-sulfonate Formula: C28H43BaO3S+ MolecularWeight: 597.03122

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCCCC)S(=O)(=O)[O-].[Ba+2]

Isomeric SMILES

CCCCCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCCCC)S(=O)(=O)[O-].[Ba+2]

InChI

InChI=1S/C28H44O3S.Ba/c1-3-5-7-9-11-13-15-19-24-23-25-20-17-18-22-27(25)28(32(29,30)31)26(24)21-16-14-12-10-8-6-4-2;/h17-18,20,22-23H,3-16,19,21H2,1-2H3,(H,29,30,31);/q;+2/p-1