(4-bromophenyl)methyl 1-(phenylsulfonyl)piperidine-2-carboxylate

Systemtic Name: (4-bromophenyl)methyl 1-(phenylsulfonyl)piperidine-2-carboxylate Openeye Name: (4-bromophenyl)methyl 1-(benzenesulfonyl)piperidine-2-carboxylate CAS Name: 1-(benzenesulfonyl)-2-piperidinecarboxylic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 1-(benzenesulfonyl)piperidine-2-carboxylate Traditional Name: 1-besylpipecolinic acid (4-bromobenzyl) ester Formula: C19H20BrNO4S MolecularWeight: 438.3354

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)OCC2=CC=C(C=C2)Br)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCN(C(C1)C(=O)OCC2=CC=C(C=C2)Br)S(=O)(=O)C3=CC=CC=C3

InChI

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