2,3-bis(7-methyloctyl)naphthalene-1-sulfonate; lead(2+)

Systemtic Name: 2,3-bis(7-methyloctyl)naphthalene-1-sulfonate; lead(2+) Openeye Name: plumbous 2,3-bis(7-methyloctyl)naphthalene-1-sulfonate CAS Name: 2,3-bis(7-methyloctyl)-1-naphthalenesulfonate; lead(2+) IUPAC Name: 2,3-bis(7-methyloctyl)naphthalene-1-sulfonate; lead(2+) Traditional Name: plumbous 2,3-bis(7-methyloctyl)naphthalene-1-sulfonate Formula: C56H86O6PbS2 MolecularWeight: 1126.60844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCC(C)C)S(=O)(=O)[O-].CC(C)CCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCC(C)C)S(=O)(=O)[O-].[Pb+2]

Isomeric SMILES

CC(C)CCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCC(C)C)S(=O)(=O)[O-].CC(C)CCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCC(C)C)S(=O)(=O)[O-].[Pb+2]

InChI

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