sodium 6-(4,6-dimethoxypyrimidin-2-yl)oxy-3-methoxycarbonyl-2-methyl-1-benzofuran-4-carboxylate

Systemtic Name: sodium 6-(4,6-dimethoxypyrimidin-2-yl)oxy-3-methoxycarbonyl-2-methyl-1-benzofuran-4-carboxylate Openeye Name: sodium 6-(4,6-dimethoxypyrimidin-2-yl)oxy-3-methoxycarbonyl-2-methyl-benzofuran-4-carboxylate CAS Name: sodium 6-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-3-methoxycarbonyl-2-methyl-4-benzofurancarboxylate IUPAC Name: sodium 6-(4,6-dimethoxypyrimidin-2-yl)oxy-3-methoxycarbonyl-2-methyl-1-benzofuran-4-carboxylate Traditional Name: sodium 3-carbomethoxy-6-(4,6-dimethoxypyrimidin-2-yl)oxy-2-methyl-benzofuran-4-carboxylate Formula: C18H15N2NaO8 MolecularWeight: 410.31007

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=C(C=C2C(=O)[O-])OC3=NC(=CC(=N3)OC)OC)C(=O)OC.[Na+]

Isomeric SMILES

CC1=C(C2=C(O1)C=C(C=C2C(=O)[O-])OC3=NC(=CC(=N3)OC)OC)C(=O)OC.[Na+]

InChI

InChI=1S/C18H16N2O8.Na/c1-8-14(17(23)26-4)15-10(16(21)22)5-9(6-11(15)27-8)28-18-19-12(24-2)7-13(20-18)25-3;/h5-7H,1-4H3,(H,21,22);/q;+1/p-1