sodium 3,7-dicarboxynaphthalene-1-sulfonate

Systemtic Name: sodium 3,7-dicarboxynaphthalene-1-sulfonate Openeye Name: sodium 3,7-dicarboxynaphthalene-1-sulfonate CAS Name: sodium 3,7-dicarboxy-1-naphthalenesulfonate IUPAC Name: sodium 3,7-dicarboxynaphthalene-1-sulfonate Traditional Name: sodium 3,7-dicarboxynaphthalene-1-sulfonate Formula: C12H7NaO7S MolecularWeight: 318.23455

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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