3,7-dicarboxynaphthalene-1-sulfonate; tributylphosphanium

Systemtic Name: 3,7-dicarboxynaphthalene-1-sulfonate; tributylphosphanium Openeye Name: 3,7-dicarboxynaphthalene-1-sulfonate; tributylphosphonium CAS Name: 3,7-dicarboxy-1-naphthalenesulfonate; tributylphosphonium IUPAC Name: 3,7-dicarboxynaphthalene-1-sulfonate; tributylphosphanium Traditional Name: 3,7-dicarboxynaphthalene-1-sulfonate; tributylphosphonium Formula: C24H35O7PS MolecularWeight: 498.569261

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[PH+](CCCC)CCCC.C1=CC(=CC2=C(C=C(C=C21)C(=O)O)S(=O)(=O)[O-])C(=O)O

Isomeric SMILES

CCCC[PH+](CCCC)CCCC.C1=CC(=CC2=C(C=C(C=C21)C(=O)O)S(=O)(=O)[O-])C(=O)O

InChI

InChI=1S/C12H8O7S.C12H27P/c13-11(14)7-2-1-6-3-8(12(15)16)5-10(9(6)4-7)20(17,18)19;1-4-7-10-13(11-8-5-2)12-9-6-3/h1-5H,(H,13,14)(H,15,16)(H,17,18,19);4-12H2,1-3H3