ethyl 1-[(1R)-2-[(4-fluorophenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(1R)-2-[(4-fluorophenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(1R)-2-(4-fluoroanilino)-2-oxo-1-phenyl-ethyl]piperidine-4-carboxylate CAS Name: 1-[(1R)-2-(4-fluoroanilino)-2-oxo-1-phenylethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(1R)-2-(4-fluoroanilino)-2-oxo-1-phenylethyl]piperidine-4-carboxylate Traditional Name: 1-[(1R)-2-(4-fluoroanilino)-2-keto-1-phenyl-ethyl]isonipecotic acid ethyl ester Formula: C22H25FN2O3 MolecularWeight: 384.443903

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C1CCN(CC1)[C@H](C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C22H25FN2O3/c1-2-28-22(27)17-12-14-25(15-13-17)20(16-6-4-3-5-7-16)21(26)24-19-10-8-18(23)9-11-19/h3-11,17,20H,2,12-15H2,1H3,(H,24,26)/t20-/m1/s1