(4-cyano-2-methoxy-phenyl) 1-(4-fluorophenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: (4-cyano-2-methoxy-phenyl) 1-(4-fluorophenyl)carbonylpiperidine-4-carboxylate Openeye Name: (4-cyano-2-methoxy-phenyl) 1-(4-fluorobenzoyl)piperidine-4-carboxylate CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-4-piperidinecarboxylic acid (4-cyano-2-methoxyphenyl) ester IUPAC Name: (4-cyano-2-methoxyphenyl) 1-(4-fluorobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(4-fluorobenzoyl)isonipecotic acid (4-cyano-2-methoxy-phenyl) ester Formula: C21H19FN2O4 MolecularWeight: 382.384963

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)OC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)OC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H19FN2O4/c1-27-19-12-14(13-23)2-7-18(19)28-21(26)16-8-10-24(11-9-16)20(25)15-3-5-17(22)6-4-15/h2-7,12,16H,8-11H2,1H3