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

Systemtic Name: 3-[4-(furan-2-ylcarbonyl)thiomorpholin-1-ium-1-yl]-6,7-dimethoxy-4-oxidanylidene-1H-quinolin-2-olate Openeye Name: 3-[4-(furan-2-carbonyl)thiomorpholin-1-ium-1-yl]-6,7-dimethoxy-4-oxo-1H-quinolin-2-olate CAS Name: 3-[4-[2-furanyl(oxo)methyl]-1-thiomorpholin-1-iumyl]-6,7-dimethoxy-4-oxo-1H-quinolin-2-olate IUPAC Name: 3-[4-(furan-2-carbonyl)thiomorpholin-1-ium-1-yl]-6,7-dimethoxy-4-oxo-1H-quinolin-2-olate Traditional Name: 3-[4-(2-furoyl)thiomorpholin-1-ium-1-yl]-4-keto-6,7-dimethoxy-1H-quinolin-2-olate Formula: C20H20N2O6S MolecularWeight: 416.4476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)C(=C(N2)[O-])[S+]3CCN(CC3)C(=O)C4=CC=CO4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)C(=C(N2)[O-])[S+]3CCN(CC3)C(=O)C4=CC=CO4)OC

InChI

InChI=1S/C20H20N2O6S/c1-26-15-10-12-13(11-16(15)27-2)21-19(24)18(17(12)23)29-8-5-22(6-9-29)20(25)14-4-3-7-28-14/h3-4,7,10-11H,5-6,8-9H2,1-2H3,(H-,21,23,24)