tert-butyl 4-[4-[(2-fluoranyl-6-methylsulfonyl-pyridin-3-yl)carbamoyl]phenoxy]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(2-fluoranyl-6-methylsulfonyl-pyridin-3-yl)carbamoyl]phenoxy]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(2-fluoro-6-methylsulfonyl-3-pyridyl)carbamoyl]phenoxy]piperidine-1-carboxylate CAS Name: 4-[4-[[(2-fluoro-6-methylsulfonyl-3-pyridinyl)amino]-oxomethyl]phenoxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(2-fluoro-6-methylsulfonylpyridin-3-yl)carbamoyl]phenoxy]piperidine-1-carboxylate Traditional Name: 4-[4-[(2-fluoro-6-mesyl-3-pyridyl)carbamoyl]phenoxy]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H28FN3O6S MolecularWeight: 493.548323

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)OC2=CC=C(C=C2)C(=O)NC3=C(N=C(C=C3)S(=O)(=O)C)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)OC2=CC=C(C=C2)C(=O)NC3=C(N=C(C=C3)S(=O)(=O)C)F

InChI

InChI=1S/C23H28FN3O6S/c1-23(2,3)33-22(29)27-13-11-17(12-14-27)32-16-7-5-15(6-8-16)21(28)25-18-9-10-19(26-20(18)24)34(4,30)31/h5-10,17H,11-14H2,1-4H3,(H,25,28)