tert-butyl 3-fluoranyl-3-(phenylmethoxycarbonylaminomethyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-fluoranyl-3-(phenylmethoxycarbonylaminomethyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-(benzyloxycarbonylaminomethyl)-3-fluoro-pyrrolidine-1-carboxylate CAS Name: 3-fluoro-3-(phenylmethoxycarbonylaminomethyl)-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-fluoro-3-(phenylmethoxycarbonylaminomethyl)pyrrolidine-1-carboxylate Traditional Name: 3-(benzyloxycarbonylaminomethyl)-3-fluoro-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C18H25FN2O4 MolecularWeight: 352.400503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1)(CNC(=O)OCC2=CC=CC=C2)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C1)(CNC(=O)OCC2=CC=CC=C2)F

InChI

InChI=1S/C18H25FN2O4/c1-17(2,3)25-16(23)21-10-9-18(19,13-21)12-20-15(22)24-11-14-7-5-4-6-8-14/h4-8H,9-13H2,1-3H3,(H,20,22)