ethyl 1-quinolin-1-ium-2-ylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-quinolin-1-ium-2-ylpiperidine-4-carboxylate Openeye Name: ethyl 1-quinolin-1-ium-2-ylpiperidine-4-carboxylate CAS Name: 1-(2-quinolin-1-iumyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-quinolin-1-ium-2-ylpiperidine-4-carboxylate Traditional Name: 1-quinolin-1-ium-2-ylisonipecotic acid ethyl ester Formula: C17H21N2O2+ MolecularWeight: 285.36084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=[NH+]C3=CC=CC=C3C=C2

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=[NH+]C3=CC=CC=C3C=C2

InChI

InChI=1S/C17H20N2O2/c1-2-21-17(20)14-9-11-19(12-10-14)16-8-7-13-5-3-4-6-15(13)18-16/h3-8,14H,2,9-12H2,1H3/p+1