N-[2-[[(3S)-3-(5-fluoranyl-2-methoxy-phenyl)carbonylpiperidin-1-yl]methyl]quinolin-6-yl]ethanamide

Systemtic Name: N-[2-[[(3S)-3-(5-fluoranyl-2-methoxy-phenyl)carbonylpiperidin-1-yl]methyl]quinolin-6-yl]ethanamide Openeye Name: N-[2-[[(3S)-3-(5-fluoro-2-methoxy-benzoyl)-1-piperidyl]methyl]-6-quinolyl]acetamide CAS Name: N-[2-[[(3S)-3-[(5-fluoro-2-methoxyphenyl)-oxomethyl]-1-piperidinyl]methyl]-6-quinolinyl]acetamide IUPAC Name: N-[2-[[(3S)-3-(5-fluoro-2-methoxybenzoyl)piperidin-1-yl]methyl]quinolin-6-yl]acetamide Traditional Name: N-[2-[[(3S)-3-(5-fluoro-2-methoxy-benzoyl)piperidino]methyl]-6-quinolyl]acetamide Formula: C25H26FN3O3 MolecularWeight: 435.490643

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N=C(C=C2)CN3CCCC(C3)C(=O)C4=C(C=CC(=C4)F)OC

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N=C(C=C2)CN3CCC[C@@H](C3)C(=O)C4=C(C=CC(=C4)F)OC

InChI

InChI=1S/C25H26FN3O3/c1-16(30)27-20-8-9-23-17(12-20)5-7-21(28-23)15-29-11-3-4-18(14-29)25(31)22-13-19(26)6-10-24(22)32-2/h5-10,12-13,18H,3-4,11,14-15H2,1-2H3,(H,27,30)/t18-/m0/s1