O1-tert-butyl O2-[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl] (2S)-pyrrolidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl] (2S)-pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-[2-(3-fluoroanilino)-2-oxo-ethyl] (2S)-pyrrolidine-1,2-dicarboxylate CAS Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[2-(3-fluoroanilino)-2-oxoethyl] ester IUPAC Name: 1-O-tert-butyl 2-O-[2-(3-fluoroanilino)-2-oxoethyl] (2S)-pyrrolidine-1,2-dicarboxylate Traditional Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[2-(3-fluoroanilino)-2-keto-ethyl] ester Formula: C18H23FN2O5 MolecularWeight: 366.384023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)OCC(=O)NC2=CC(=CC=C2)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)OCC(=O)NC2=CC(=CC=C2)F

InChI

InChI=1S/C18H23FN2O5/c1-18(2,3)26-17(24)21-9-5-8-14(21)16(23)25-11-15(22)20-13-7-4-6-12(19)10-13/h4,6-7,10,14H,5,8-9,11H2,1-3H3,(H,20,22)/t14-/m0/s1