(phenylmethyl) 4-[[5-(4-methylsulfonylphenyl)pyridin-2-yl]oxymethyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[[5-(4-methylsulfonylphenyl)pyridin-2-yl]oxymethyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[[5-(4-methylsulfonylphenyl)-2-pyridyl]oxymethyl]piperidine-1-carboxylate CAS Name: 4-[[5-(4-methylsulfonylphenyl)-2-pyridinyl]oxymethyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[[5-(4-methylsulfonylphenyl)pyridin-2-yl]oxymethyl]piperidine-1-carboxylate Traditional Name: 4-[[5-(4-mesylphenyl)-2-pyridyl]oxymethyl]piperidine-1-carboxylic acid benzyl ester Formula: C26H28N2O5S MolecularWeight: 480.57592

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CN=C(C=C2)OCC3CCN(CC3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CN=C(C=C2)OCC3CCN(CC3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H28N2O5S/c1-34(30,31)24-10-7-22(8-11-24)23-9-12-25(27-17-23)32-18-21-13-15-28(16-14-21)26(29)33-19-20-5-3-2-4-6-20/h2-12,17,21H,13-16,18-19H2,1H3