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

Systemtic Name: 2,3-di(nonyl)naphthalene-1-sulfonate; nickel(2+) Openeye Name: nickelous 2,3-di(nonyl)naphthalene-1-sulfonate CAS Name: 2,3-di(nonyl)-1-naphthalenesulfonate; nickel(2+) IUPAC Name: 2,3-di(nonyl)naphthalene-1-sulfonate; nickel(2+) Traditional Name: nickelous 2,3-di(nonyl)naphthalene-1-sulfonate Formula: C56H86NiO6S2 MolecularWeight: 978.10184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C28H44O3S.Ni/c2*1-3-5-7-9-11-13-15-19-24-23-25-20-17-18-22-27(25)28(32(29,30)31)26(24)21-16-14-12-10-8-6-4-2;/h2*17-18,20,22-23H,3-16,19,21H2,1-2H3,(H,29,30,31);/q;;+2/p-2