ethyl 1-(6-fluoranyl-4-methyl-quinolin-1-ium-2-yl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-(6-fluoranyl-4-methyl-quinolin-1-ium-2-yl)piperidine-4-carboxylate Openeye Name: ethyl 1-(6-fluoro-4-methyl-quinolin-1-ium-2-yl)piperidine-4-carboxylate CAS Name: 1-(6-fluoro-4-methyl-2-quinolin-1-iumyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(6-fluoro-4-methylquinolin-1-ium-2-yl)piperidine-4-carboxylate Traditional Name: 1-(6-fluoro-4-methyl-quinolin-1-ium-2-yl)isonipecotic acid ethyl ester Formula: C18H22FN2O2+ MolecularWeight: 317.377883

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=[NH+]C3=C(C=C(C=C3)F)C(=C2)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=[NH+]C3=C(C=C(C=C3)F)C(=C2)C

InChI

InChI=1S/C18H21FN2O2/c1-3-23-18(22)13-6-8-21(9-7-13)17-10-12(2)15-11-14(19)4-5-16(15)20-17/h4-5,10-11,13H,3,6-9H2,1-2H3/p+1