(phenylmethyl) 3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-(trifluoromethyl)pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-(trifluoromethyl)pyrrolidine-1-carboxylate Openeye Name: benzyl 3-[(tert-butoxycarbonylamino)methyl]-4-(trifluoromethyl)pyrrolidine-1-carboxylate CAS Name: 3-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]-4-(trifluoromethyl)-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-(trifluoromethyl)pyrrolidine-1-carboxylate Traditional Name: 3-[(tert-butoxycarbonylamino)methyl]-4-(trifluoromethyl)pyrrolidine-1-carboxylic acid benzyl ester Formula: C19H25F3N2O4 MolecularWeight: 402.40801

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1CN(CC1C(F)(F)F)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NCC1CN(CC1C(F)(F)F)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H25F3N2O4/c1-18(2,3)28-16(25)23-9-14-10-24(11-15(14)19(20,21)22)17(26)27-12-13-7-5-4-6-8-13/h4-8,14-15H,9-12H2,1-3H3,(H,23,25)