5-[(1R)-4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl]-2-sulfanylidene-1H-pyrimidine-4,6-diolate

Systemtic Name: 5-[(1R)-4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl]-2-sulfanylidene-1H-pyrimidine-4,6-diolate Openeye Name: 5-[(1R)-4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl]-2-thioxo-1H-pyrimidine-4,6-diolate CAS Name: 5-[(1R)-4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl]-2-sulfanylidene-1H-pyrimidine-4,6-diolate IUPAC Name: 5-[(1R)-4,5-dimethoxy-3-oxo-1H-2-benzofuran-1-yl]-2-sulfanylidene-1H-pyrimidine-4,6-diolate Traditional Name: 5-[(1R)-3-keto-4,5-dimethoxy-phthalan-1-yl]-2-thioxo-1H-pyrimidine-4,6-diolate Formula: C14H10N2O6S-2 MolecularWeight: 334.304

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC2=O)C3=C(NC(=S)N=C3[O-])[O-])OC

Isomeric SMILES

COC1=C(C2=C(C=C1)[C@@H](OC2=O)C3=C(NC(=S)N=C3[O-])[O-])OC

InChI

InChI=1S/C14H12N2O6S/c1-20-6-4-3-5-7(10(6)21-2)13(19)22-9(5)8-11(17)15-14(23)16-12(8)18/h3-4,9H,1-2H3,(H3,15,16,17,18,23)/p-2/t9-/m1/s1