[6-(dimethylamino)-2-ethoxycarbonyl-4-oxidanylidene-1H-quinolin-3-yl]methyl-methyl-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [6-(dimethylamino)-2-ethoxycarbonyl-4-oxidanylidene-1H-quinolin-3-yl]methyl-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: [6-(dimethylamino)-2-ethoxycarbonyl-4-oxo-1H-quinolin-3-yl]methyl-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: [6-(dimethylamino)-2-ethoxycarbonyl-4-oxo-1H-quinolin-3-yl]methyl-methyl-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [6-(dimethylamino)-2-ethoxycarbonyl-4-oxo-1H-quinolin-3-yl]methyl-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: [2-carbethoxy-6-(dimethylamino)-4-keto-1H-quinolin-3-yl]methyl-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C22H34N4O3+2 MolecularWeight: 402.53036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C2=C(N1)C=CC(=C2)N(C)C)C[NH+](C)C3CC[NH+](CC3)C

Isomeric SMILES

CCOC(=O)C1=C(C(=O)C2=C(N1)C=CC(=C2)N(C)C)C[NH+](C)C3CC[NH+](CC3)C

InChI

InChI=1S/C22H32N4O3/c1-6-29-22(28)20-18(14-26(5)15-9-11-25(4)12-10-15)21(27)17-13-16(24(2)3)7-8-19(17)23-20/h7-8,13,15H,6,9-12,14H2,1-5H3,(H,23,27)/p+2