6-[6-[2,3-bis(oxidanyl)propoxy]quinolin-4-yl]oxy-N,2-dimethyl-1-benzofuran-3-carboxamide

Systemtic Name: 6-[6-[2,3-bis(oxidanyl)propoxy]quinolin-4-yl]oxy-N,2-dimethyl-1-benzofuran-3-carboxamide Openeye Name: 6-[[6-(2,3-dihydroxypropoxy)-4-quinolyl]oxy]-N,2-dimethyl-benzofuran-3-carboxamide CAS Name: 6-[[6-(2,3-dihydroxypropoxy)-4-quinolinyl]oxy]-N,2-dimethyl-3-benzofurancarboxamide IUPAC Name: 6-[6-(2,3-dihydroxypropoxy)quinolin-4-yl]oxy-N,2-dimethyl-1-benzofuran-3-carboxamide Traditional Name: 6-[(6-glyceryloxy-4-quinolyl)oxy]-N,2-dimethyl-benzofuran-3-carboxamide Formula: C23H22N2O6 MolecularWeight: 422.43058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=C(C=C2)OC3=C4C=C(C=CC4=NC=C3)OCC(CO)O)C(=O)NC

Isomeric SMILES

CC1=C(C2=C(O1)C=C(C=C2)OC3=C4C=C(C=CC4=NC=C3)OCC(CO)O)C(=O)NC

InChI

InChI=1S/C23H22N2O6/c1-13-22(23(28)24-2)17-5-3-16(10-21(17)30-13)31-20-7-8-25-19-6-4-15(9-18(19)20)29-12-14(27)11-26/h3-10,14,26-27H,11-12H2,1-2H3,(H,24,28)