1-[(2-methylpropan-2-yl)oxycarbonyl]-4-[6-methyl-2-(trifluoromethyl)quinolin-4-yl]oxy-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2-methylpropan-2-yl)oxycarbonyl]-4-[6-methyl-2-(trifluoromethyl)quinolin-4-yl]oxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-tert-butoxycarbonyl-4-[[6-methyl-2-(trifluoromethyl)-4-quinolyl]oxy]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-[[6-methyl-2-(trifluoromethyl)-4-quinolinyl]oxy]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2-methylpropan-2-yl)oxycarbonyl]-4-[6-methyl-2-(trifluoromethyl)quinolin-4-yl]oxypyrrolidine-2-carboxylic acid Traditional Name: 1-tert-butoxycarbonyl-4-[[6-methyl-2-(trifluoromethyl)-4-quinolyl]oxy]proline Formula: C21H23F3N2O5 MolecularWeight: 440.41293

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2OC3CC(N(C3)C(=O)OC(C)(C)C)C(=O)O)C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2OC3CC(N(C3)C(=O)OC(C)(C)C)C(=O)O)C(F)(F)F

InChI

InChI=1S/C21H23F3N2O5/c1-11-5-6-14-13(7-11)16(9-17(25-14)21(22,23)24)30-12-8-15(18(27)28)26(10-12)19(29)31-20(2,3)4/h5-7,9,12,15H,8,10H2,1-4H3,(H,27,28)