sodium 6-methylsulfinyl-9-oxidanylidene-xanthene-2-carboxylate

Systemtic Name: sodium 6-methylsulfinyl-9-oxidanylidene-xanthene-2-carboxylate Openeye Name: sodium 6-methylsulfinyl-9-oxo-xanthene-2-carboxylate CAS Name: sodium 6-methylsulfinyl-9-oxo-2-xanthenecarboxylate IUPAC Name: sodium 6-methylsulfinyl-9-oxoxanthene-2-carboxylate Traditional Name: sodium 9-keto-6-methylsulfinyl-xanthene-2-carboxylate Formula: C15H9NaO5S MolecularWeight: 324.28373

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=CC2=C(C=C1)C(=O)C3=C(O2)C=CC(=C3)C(=O)[O-].[Na+]

Isomeric SMILES

CS(=O)C1=CC2=C(C=C1)C(=O)C3=C(O2)C=CC(=C3)C(=O)[O-].[Na+]

InChI

InChI=1S/C15H10O5S.Na/c1-21(19)9-3-4-10-13(7-9)20-12-5-2-8(15(17)18)6-11(12)14(10)16;/h2-7H,1H3,(H,17,18);/q;+1/p-1