trisodium 4-sulfonatonaphthalene-2,6-dicarboxylate

Systemtic Name: trisodium 4-sulfonatonaphthalene-2,6-dicarboxylate Openeye Name: trisodium 4-sulfonatonaphthalene-2,6-dicarboxylate CAS Name: trisodium 4-sulfonatonaphthalene-2,6-dicarboxylate IUPAC Name: trisodium 4-sulfonatonaphthalene-2,6-dicarboxylate Traditional Name: trisodium 4-sulfonatonaphthalene-2,6-dicarboxylate Formula: C12H5Na3O7S MolecularWeight: 362.19821

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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+].[Na+].[Na+]

Isomeric SMILES

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

InChI

InChI=1S/C12H8O7S.3Na/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;3*+1/p-3