tert-butyl (2R,4R)-2-[[2-fluoranyl-4-(2-oxidanylidenepiperidin-1-yl)phenyl]carbamoyl]-4-methoxy-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2R,4R)-2-[[2-fluoranyl-4-(2-oxidanylidenepiperidin-1-yl)phenyl]carbamoyl]-4-methoxy-pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2R,4R)-2-[[2-fluoro-4-(2-oxo-1-piperidyl)phenyl]carbamoyl]-4-methoxy-pyrrolidine-1-carboxylate CAS Name: (2R,4R)-2-[[2-fluoro-4-(2-oxo-1-piperidinyl)anilino]-oxomethyl]-4-methoxy-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,4R)-2-[[2-fluoro-4-(2-oxopiperidin-1-yl)phenyl]carbamoyl]-4-methoxypyrrolidine-1-carboxylate Traditional Name: (2R,4R)-2-[[2-fluoro-4-(2-ketopiperidino)phenyl]carbamoyl]-4-methoxy-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C22H30FN3O5 MolecularWeight: 435.489103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)NC2=C(C=C(C=C2)N3CCCCC3=O)F)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@@H](C[C@@H]1C(=O)NC2=C(C=C(C=C2)N3CCCCC3=O)F)OC

InChI

InChI=1S/C22H30FN3O5/c1-22(2,3)31-21(29)26-13-15(30-4)12-18(26)20(28)24-17-9-8-14(11-16(17)23)25-10-6-5-7-19(25)27/h8-9,11,15,18H,5-7,10,12-13H2,1-4H3,(H,24,28)/t15-,18-/m1/s1