[(1R)-1-cyanoethyl] 1-(4-bromophenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: [(1R)-1-cyanoethyl] 1-(4-bromophenyl)carbonylpiperidine-4-carboxylate Openeye Name: [(1R)-1-cyanoethyl] 1-(4-bromobenzoyl)piperidine-4-carboxylate CAS Name: 1-[(4-bromophenyl)-oxomethyl]-4-piperidinecarboxylic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] 1-(4-bromobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(4-bromobenzoyl)isonipecotic acid [(1R)-1-cyanoethyl] ester Formula: C16H17BrN2O3 MolecularWeight: 365.22178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C[C@H](C#N)OC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H17BrN2O3/c1-11(10-18)22-16(21)13-6-8-19(9-7-13)15(20)12-2-4-14(17)5-3-12/h2-5,11,13H,6-9H2,1H3/t11-/m1/s1