(3-bromophenyl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate

Systemtic Name: (3-bromophenyl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate Openeye Name: (3-bromophenyl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate CAS Name: 1-[anilino(oxo)methyl]-4-piperidinecarboxylic acid (3-bromophenyl)methyl ester IUPAC Name: (3-bromophenyl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate Traditional Name: 1-(phenylcarbamoyl)isonipecotic acid (3-bromobenzyl) ester Formula: C20H21BrN2O3 MolecularWeight: 417.29634

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC2=CC(=CC=C2)Br)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)OCC2=CC(=CC=C2)Br)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H21BrN2O3/c21-17-6-4-5-15(13-17)14-26-19(24)16-9-11-23(12-10-16)20(25)22-18-7-2-1-3-8-18/h1-8,13,16H,9-12,14H2,(H,22,25)