tert-butyl 4-[6-[(2-fluoranyl-4-methylsulfonyl-phenoxy)methyl]pyridin-2-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[6-[(2-fluoranyl-4-methylsulfonyl-phenoxy)methyl]pyridin-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[6-[(2-fluoro-4-methylsulfonyl-phenoxy)methyl]-2-pyridyl]piperidine-1-carboxylate CAS Name: 4-[6-[(2-fluoro-4-methylsulfonylphenoxy)methyl]-2-pyridinyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[6-[(2-fluoro-4-methylsulfonylphenoxy)methyl]pyridin-2-yl]piperidine-1-carboxylate Traditional Name: 4-[6-[(2-fluoro-4-mesyl-phenoxy)methyl]-2-pyridyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H29FN2O5S MolecularWeight: 464.550163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CC=C2)COC3=C(C=C(C=C3)S(=O)(=O)C)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CC=C2)COC3=C(C=C(C=C3)S(=O)(=O)C)F

InChI

InChI=1S/C23H29FN2O5S/c1-23(2,3)31-22(27)26-12-10-16(11-13-26)20-7-5-6-17(25-20)15-30-21-9-8-18(14-19(21)24)32(4,28)29/h5-9,14,16H,10-13,15H2,1-4H3