(4-bromophenyl)methyl 1-[2,4-bis(fluoranyl)phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: (4-bromophenyl)methyl 1-[2,4-bis(fluoranyl)phenyl]carbonylpiperidine-4-carboxylate Openeye Name: (4-bromophenyl)methyl 1-(2,4-difluorobenzoyl)piperidine-4-carboxylate CAS Name: 1-[(2,4-difluorophenyl)-oxomethyl]-4-piperidinecarboxylic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 1-(2,4-difluorobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(2,4-difluorobenzoyl)isonipecotic acid (4-bromobenzyl) ester Formula: C20H18BrF2NO3 MolecularWeight: 438.262626

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC2=CC=C(C=C2)Br)C(=O)C3=C(C=C(C=C3)F)F

Isomeric SMILES

C1CN(CCC1C(=O)OCC2=CC=C(C=C2)Br)C(=O)C3=C(C=C(C=C3)F)F

InChI

InChI=1S/C20H18BrF2NO3/c21-15-3-1-13(2-4-15)12-27-20(26)14-7-9-24(10-8-14)19(25)17-6-5-16(22)11-18(17)23/h1-6,11,14H,7-10,12H2