ethyl 1-[2-(4-fluorophenyl)-6-methyl-quinolin-4-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-(4-fluorophenyl)-6-methyl-quinolin-4-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[2-(4-fluorophenyl)-6-methyl-quinoline-4-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[2-(4-fluorophenyl)-6-methyl-4-quinolinyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-fluorophenyl)-6-methylquinoline-4-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[2-(4-fluorophenyl)-6-methyl-quinoline-4-carbonyl]nipecotic acid ethyl ester Formula: C25H25FN2O3 MolecularWeight: 420.476003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=NC3=C2C=C(C=C3)C)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=NC3=C2C=C(C=C3)C)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H25FN2O3/c1-3-31-25(30)18-5-4-12-28(15-18)24(29)21-14-23(17-7-9-19(26)10-8-17)27-22-11-6-16(2)13-20(21)22/h6-11,13-14,18H,3-5,12,15H2,1-2H3