(3R)-3-(methylamino)-4-[4-methyl-5-[[4-(2-methylpropyl)-3-(trifluoromethyloxy)phenyl]methoxy]-2,3-dihydroindol-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: (3R)-3-(methylamino)-4-[4-methyl-5-[[4-(2-methylpropyl)-3-(trifluoromethyloxy)phenyl]methoxy]-2,3-dihydroindol-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: (3R)-4-[5-[[4-isobutyl-3-(trifluoromethoxy)phenyl]methoxy]-4-methyl-indolin-1-yl]-3-(methylamino)-4-oxo-butanoic acid CAS Name: (3R)-3-(methylamino)-4-[4-methyl-5-[[4-(2-methylpropyl)-3-(trifluoromethoxy)phenyl]methoxy]-2,3-dihydroindol-1-yl]-4-oxobutanoic acid IUPAC Name: (3R)-3-(methylamino)-4-[4-methyl-5-[[4-(2-methylpropyl)-3-(trifluoromethoxy)phenyl]methoxy]-2,3-dihydroindol-1-yl]-4-oxobutanoic acid Traditional Name: (3R)-4-[5-[4-isobutyl-3-(trifluoromethoxy)benzyl]oxy-4-methyl-indolin-1-yl]-4-keto-3-(methylamino)butyric acid Formula: C26H31F3N2O5 MolecularWeight: 508.52995

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1CCN2C(=O)C(CC(=O)O)NC)OCC3=CC(=C(C=C3)CC(C)C)OC(F)(F)F

Isomeric SMILES

CC1=C(C=CC2=C1CCN2C(=O)[C@@H](CC(=O)O)NC)OCC3=CC(=C(C=C3)CC(C)C)OC(F)(F)F

InChI

InChI=1S/C26H31F3N2O5/c1-15(2)11-18-6-5-17(12-23(18)36-26(27,28)29)14-35-22-8-7-21-19(16(22)3)9-10-31(21)25(34)20(30-4)13-24(32)33/h5-8,12,15,20,30H,9-11,13-14H2,1-4H3,(H,32,33)/t20-/m1/s1