tert-butyl 4-[[1-(4-methylsulfonylphenyl)piperidin-4-yl]oxymethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[1-(4-methylsulfonylphenyl)piperidin-4-yl]oxymethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[1-(4-methylsulfonylphenyl)-4-piperidyl]oxymethyl]piperidine-1-carboxylate CAS Name: 4-[[1-(4-methylsulfonylphenyl)-4-piperidinyl]oxymethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[1-(4-methylsulfonylphenyl)piperidin-4-yl]oxymethyl]piperidine-1-carboxylate Traditional Name: 4-[[1-(4-mesylphenyl)-4-piperidyl]oxymethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H36N2O5S MolecularWeight: 452.60734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)COC2CCN(CC2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)COC2CCN(CC2)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C23H36N2O5S/c1-23(2,3)30-22(26)25-13-9-18(10-14-25)17-29-20-11-15-24(16-12-20)19-5-7-21(8-6-19)31(4,27)28/h5-8,18,20H,9-17H2,1-4H3