(3-bromophenyl)methyl (3R)-1-(phenylsulfonyl)piperidine-3-carboxylate

Systemtic Name: (3-bromophenyl)methyl (3R)-1-(phenylsulfonyl)piperidine-3-carboxylate Openeye Name: (3-bromophenyl)methyl (3R)-1-(benzenesulfonyl)piperidine-3-carboxylate CAS Name: (3R)-1-(benzenesulfonyl)-3-piperidinecarboxylic acid (3-bromophenyl)methyl ester IUPAC Name: (3-bromophenyl)methyl (3R)-1-(benzenesulfonyl)piperidine-3-carboxylate Traditional Name: (3R)-1-besylnipecotic acid (3-bromobenzyl) ester Formula: C19H20BrNO4S MolecularWeight: 438.3354

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)OCC3=CC(=CC=C3)Br

Isomeric SMILES

C1C[C@H](CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)OCC3=CC(=CC=C3)Br

InChI

InChI=1S/C19H20BrNO4S/c20-17-8-4-6-15(12-17)14-25-19(22)16-7-5-11-21(13-16)26(23,24)18-9-2-1-3-10-18/h1-4,6,8-10,12,16H,5,7,11,13-14H2/t16-/m1/s1