(4-phenylmethoxyphenyl) 1-(phenylsulfonyl)piperidine-2-carboxylate

Systemtic Name: (4-phenylmethoxyphenyl) 1-(phenylsulfonyl)piperidine-2-carboxylate Openeye Name: (4-benzyloxyphenyl) 1-(benzenesulfonyl)piperidine-2-carboxylate CAS Name: 1-(benzenesulfonyl)-2-piperidinecarboxylic acid (4-phenylmethoxyphenyl) ester IUPAC Name: (4-phenylmethoxyphenyl) 1-(benzenesulfonyl)piperidine-2-carboxylate Traditional Name: 1-besylpipecolinic acid (4-benzoxyphenyl) ester Formula: C25H25NO5S MolecularWeight: 451.5347

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)OC2=CC=C(C=C2)OCC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C(C1)C(=O)OC2=CC=C(C=C2)OCC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H25NO5S/c27-25(24-13-7-8-18-26(24)32(28,29)23-11-5-2-6-12-23)31-22-16-14-21(15-17-22)30-19-20-9-3-1-4-10-20/h1-6,9-12,14-17,24H,7-8,13,18-19H2