5-(4,6-dimethoxypyrimidin-2-yl)oxy-2-methyl-3-propoxycarbonyl-1-benzofuran-4-carboxylic acid

Systemtic Name: 5-(4,6-dimethoxypyrimidin-2-yl)oxy-2-methyl-3-propoxycarbonyl-1-benzofuran-4-carboxylic acid Openeye Name: 5-(4,6-dimethoxypyrimidin-2-yl)oxy-2-methyl-3-propoxycarbonyl-benzofuran-4-carboxylic acid CAS Name: 5-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-2-methyl-3-[oxo(propoxy)methyl]-4-benzofurancarboxylic acid IUPAC Name: 5-(4,6-dimethoxypyrimidin-2-yl)oxy-2-methyl-3-propoxycarbonyl-1-benzofuran-4-carboxylic acid Traditional Name: 5-(4,6-dimethoxypyrimidin-2-yl)oxy-2-methyl-3-propoxycarbonyl-benzofuran-4-carboxylic acid Formula: C20H20N2O8 MolecularWeight: 416.3814

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(OC2=C1C(=C(C=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)O)C

Isomeric SMILES

CCCOC(=O)C1=C(OC2=C1C(=C(C=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)O)C

InChI

InChI=1S/C20H20N2O8/c1-5-8-28-19(25)15-10(2)29-11-6-7-12(17(16(11)15)18(23)24)30-20-21-13(26-3)9-14(22-20)27-4/h6-7,9H,5,8H2,1-4H3,(H,23,24)