3-[4-(furan-2-ylcarbonyl)thiomorpholin-1-ium-1-yl]-6,7-dimethoxy-1-methyl-4-oxidanylidene-quinolin-2-olate

Systemtic Name: 3-[4-(furan-2-ylcarbonyl)thiomorpholin-1-ium-1-yl]-6,7-dimethoxy-1-methyl-4-oxidanylidene-quinolin-2-olate Openeye Name: 3-[4-(furan-2-carbonyl)thiomorpholin-1-ium-1-yl]-6,7-dimethoxy-1-methyl-4-oxo-quinolin-2-olate CAS Name: 3-[4-[2-furanyl(oxo)methyl]-1-thiomorpholin-1-iumyl]-6,7-dimethoxy-1-methyl-4-oxo-2-quinolinolate IUPAC Name: 3-[4-(furan-2-carbonyl)thiomorpholin-1-ium-1-yl]-6,7-dimethoxy-1-methyl-4-oxoquinolin-2-olate Traditional Name: 3-[4-(2-furoyl)thiomorpholin-1-ium-1-yl]-4-keto-6,7-dimethoxy-1-methyl-quinolin-2-olate Formula: C21H22N2O6S MolecularWeight: 430.47418

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC(=C(C=C2C(=O)C(=C1[O-])[S+]3CCN(CC3)C(=O)C4=CC=CO4)OC)OC

Isomeric SMILES

CN1C2=CC(=C(C=C2C(=O)C(=C1[O-])[S+]3CCN(CC3)C(=O)C4=CC=CO4)OC)OC

InChI

InChI=1S/C21H22N2O6S/c1-22-14-12-17(28-3)16(27-2)11-13(14)18(24)19(21(22)26)30-9-6-23(7-10-30)20(25)15-5-4-8-29-15/h4-5,8,11-12H,6-7,9-10H2,1-3H3