2-methyl-3-[[methyl-(1-methylpiperidin-1-ium-4-yl)azaniumyl]methyl]-4-oxidanylidene-1H-quinoline-6-carboxylate

Systemtic Name: 2-methyl-3-[[methyl-(1-methylpiperidin-1-ium-4-yl)azaniumyl]methyl]-4-oxidanylidene-1H-quinoline-6-carboxylate Openeye Name: 2-methyl-3-[[methyl-(1-methylpiperidin-1-ium-4-yl)ammonio]methyl]-4-oxo-1H-quinoline-6-carboxylate CAS Name: 2-methyl-3-[[methyl-(1-methyl-4-piperidin-1-iumyl)ammonio]methyl]-4-oxo-1H-quinoline-6-carboxylate IUPAC Name: 2-methyl-3-[[methyl-(1-methylpiperidin-1-ium-4-yl)azaniumyl]methyl]-4-oxo-1H-quinoline-6-carboxylate Traditional Name: 4-keto-2-methyl-3-[[methyl-(1-methylpiperidin-1-ium-4-yl)ammonio]methyl]-1H-quinoline-6-carboxylate Formula: C19H26N3O3+ MolecularWeight: 344.42804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(N1)C=CC(=C2)C(=O)[O-])C[NH+](C)C3CC[NH+](CC3)C

Isomeric SMILES

CC1=C(C(=O)C2=C(N1)C=CC(=C2)C(=O)[O-])C[NH+](C)C3CC[NH+](CC3)C

InChI

InChI=1S/C19H25N3O3/c1-12-16(11-22(3)14-6-8-21(2)9-7-14)18(23)15-10-13(19(24)25)4-5-17(15)20-12/h4-5,10,14H,6-9,11H2,1-3H3,(H,20,23)(H,24,25)/p+1