(3-fluoranyl-4-methoxy-phenyl)methyl 1-(4-fluorophenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 1-(4-fluorophenyl)carbonylpiperidine-4-carboxylate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 1-(4-fluorobenzoyl)piperidine-4-carboxylate CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-4-piperidinecarboxylic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 1-(4-fluorobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(4-fluorobenzoyl)isonipecotic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C21H21F2NO4 MolecularWeight: 389.392546

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F)F

Isomeric SMILES

COC1=C(C=C(C=C1)COC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F)F

InChI

InChI=1S/C21H21F2NO4/c1-27-19-7-2-14(12-18(19)23)13-28-21(26)16-8-10-24(11-9-16)20(25)15-3-5-17(22)6-4-15/h2-7,12,16H,8-11,13H2,1H3