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

Systemtic Name: tert-butyl 4-[[5-(4-methylsulfonylphenyl)pyridin-2-yl]oxymethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[5-(4-methylsulfonylphenyl)-2-pyridyl]oxymethyl]piperidine-1-carboxylate CAS Name: 4-[[5-(4-methylsulfonylphenyl)-2-pyridinyl]oxymethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[5-(4-methylsulfonylphenyl)pyridin-2-yl]oxymethyl]piperidine-1-carboxylate Traditional Name: 4-[[5-(4-mesylphenyl)-2-pyridyl]oxymethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H30N2O5S MolecularWeight: 446.5597

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)COC2=NC=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)COC2=NC=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C23H30N2O5S/c1-23(2,3)30-22(26)25-13-11-17(12-14-25)16-29-21-10-7-19(15-24-21)18-5-8-20(9-6-18)31(4,27)28/h5-10,15,17H,11-14,16H2,1-4H3