(4-phenylmethoxyphenyl) 1-methylsulfonylpiperidine-4-carboxylate

Systemtic Name: (4-phenylmethoxyphenyl) 1-methylsulfonylpiperidine-4-carboxylate Openeye Name: (4-benzyloxyphenyl) 1-methylsulfonylpiperidine-4-carboxylate CAS Name: 1-methylsulfonyl-4-piperidinecarboxylic acid (4-phenylmethoxyphenyl) ester IUPAC Name: (4-phenylmethoxyphenyl) 1-methylsulfonylpiperidine-4-carboxylate Traditional Name: 1-mesylisonipecotic acid (4-benzoxyphenyl) ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)OC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)OC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C20H23NO5S/c1-27(23,24)21-13-11-17(12-14-21)20(22)26-19-9-7-18(8-10-19)25-15-16-5-3-2-4-6-16/h2-10,17H,11-15H2,1H3