(phenylmethyl) (2S,4S)-4-fluoranyl-2-[[(1S,3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopentyl]methylcarbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S,4S)-4-fluoranyl-2-[[(1S,3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopentyl]methylcarbamoyl]pyrrolidine-1-carboxylate Openeye Name: benzyl (2S,4S)-2-[[(1S,3R)-3-(tert-butoxycarbonylamino)cyclopentyl]methylcarbamoyl]-4-fluoro-pyrrolidine-1-carboxylate CAS Name: (2S,4S)-4-fluoro-2-[[[(1S,3R)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]cyclopentyl]methylamino]-oxomethyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,4S)-4-fluoro-2-[[(1S,3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopentyl]methylcarbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2S,4S)-2-[[(1S,3R)-3-(tert-butoxycarbonylamino)cyclopentyl]methylcarbamoyl]-4-fluoro-pyrrolidine-1-carboxylic acid benzyl ester Formula: C24H34FN3O5 MolecularWeight: 463.542263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCC(C1)CNC(=O)C2CC(CN2C(=O)OCC3=CC=CC=C3)F

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H]1CC[C@@H](C1)CNC(=O)[C@@H]2C[C@@H](CN2C(=O)OCC3=CC=CC=C3)F

InChI

InChI=1S/C24H34FN3O5/c1-24(2,3)33-22(30)27-19-10-9-17(11-19)13-26-21(29)20-12-18(25)14-28(20)23(31)32-15-16-7-5-4-6-8-16/h4-8,17-20H,9-15H2,1-3H3,(H,26,29)(H,27,30)/t17-,18-,19+,20-/m0/s1