ethyl 1-[2-(2,4-dimethoxyphenyl)-6-fluoranyl-quinolin-4-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(2,4-dimethoxyphenyl)-6-fluoranyl-quinolin-4-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[2-(2,4-dimethoxyphenyl)-6-fluoro-quinoline-4-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[2-(2,4-dimethoxyphenyl)-6-fluoro-4-quinolinyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(2,4-dimethoxyphenyl)-6-fluoroquinoline-4-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[2-(2,4-dimethoxyphenyl)-6-fluoro-quinoline-4-carbonyl]isonipecotic acid ethyl ester Formula: C26H27FN2O5 MolecularWeight: 466.501383

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=NC3=C2C=C(C=C3)F)C4=C(C=C(C=C4)OC)OC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=NC3=C2C=C(C=C3)F)C4=C(C=C(C=C4)OC)OC

InChI

InChI=1S/C26H27FN2O5/c1-4-34-26(31)16-9-11-29(12-10-16)25(30)21-15-23(28-22-8-5-17(27)13-20(21)22)19-7-6-18(32-2)14-24(19)33-3/h5-8,13-16H,4,9-12H2,1-3H3