2-[[4-methoxy-3-[[4-(trifluoromethyl)phenyl]methylcarbamoyl]phenyl]methyl]-3-methyl-butanoic acid

Systemtic Name: 2-[[4-methoxy-3-[[4-(trifluoromethyl)phenyl]methylcarbamoyl]phenyl]methyl]-3-methyl-butanoic acid Openeye Name: 2-[[4-methoxy-3-[[4-(trifluoromethyl)phenyl]methylcarbamoyl]phenyl]methyl]-3-methyl-butanoic acid CAS Name: 2-[[4-methoxy-3-[oxo-[[4-(trifluoromethyl)phenyl]methylamino]methyl]phenyl]methyl]-3-methylbutanoic acid IUPAC Name: 2-[[4-methoxy-3-[[4-(trifluoromethyl)phenyl]methylcarbamoyl]phenyl]methyl]-3-methylbutanoic acid Traditional Name: 2-[4-methoxy-3-[[4-(trifluoromethyl)benzyl]carbamoyl]benzyl]-3-methyl-butyric acid Formula: C22H24F3NO4 MolecularWeight: 423.42547

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC1=CC(=C(C=C1)OC)C(=O)NCC2=CC=C(C=C2)C(F)(F)F)C(=O)O

Isomeric SMILES

CC(C)C(CC1=CC(=C(C=C1)OC)C(=O)NCC2=CC=C(C=C2)C(F)(F)F)C(=O)O

InChI

InChI=1S/C22H24F3NO4/c1-13(2)17(21(28)29)10-15-6-9-19(30-3)18(11-15)20(27)26-12-14-4-7-16(8-5-14)22(23,24)25/h4-9,11,13,17H,10,12H2,1-3H3,(H,26,27)(H,28,29)