methyl 4-methyl-2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]quinoline-3-carboxylate

Systemtic Name: methyl 4-methyl-2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]quinoline-3-carboxylate Openeye Name: methyl 4-methyl-2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]quinoline-3-carboxylate CAS Name: 4-methyl-2-[[(2S)-2-methyl-1-piperidin-1-iumyl]methyl]-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]quinoline-3-carboxylate Traditional Name: 4-methyl-2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]quinoline-3-carboxylic acid methyl ester Formula: C19H25N2O2+ MolecularWeight: 313.414

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC2=NC3=CC=CC=C3C(=C2C(=O)OC)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC2=NC3=CC=CC=C3C(=C2C(=O)OC)C

InChI

InChI=1S/C19H24N2O2/c1-13-8-6-7-11-21(13)12-17-18(19(22)23-3)14(2)15-9-4-5-10-16(15)20-17/h4-5,9-10,13H,6-8,11-12H2,1-3H3/p+1/t13-/m0/s1