3-[[4-[(Z)-C-methyl-N-[[4-(4-methylphenyl)-2-(trifluoromethyl)phenyl]methoxy]carbonimidoyl]phenyl]methylamino]propanoic acid

Systemtic Name: 3-[[4-[(Z)-C-methyl-N-[[4-(4-methylphenyl)-2-(trifluoromethyl)phenyl]methoxy]carbonimidoyl]phenyl]methylamino]propanoic acid Openeye Name: 3-[[4-[(Z)-C-methyl-N-[[4-(p-tolyl)-2-(trifluoromethyl)phenyl]methoxy]carbonimidoyl]phenyl]methylamino]propanoic acid CAS Name: 3-[[4-[(1Z)-1-[[4-(4-methylphenyl)-2-(trifluoromethyl)phenyl]methoxyimino]ethyl]phenyl]methylamino]propanoic acid IUPAC Name: 3-[[4-[(Z)-C-methyl-N-[[4-(4-methylphenyl)-2-(trifluoromethyl)phenyl]methoxy]carbonimidoyl]phenyl]methylamino]propanoic acid Traditional Name: 3-[[4-[(Z)-C-methyl-N-[4-(p-tolyl)-2-(trifluoromethyl)benzyl]oxy-carbonimidoyl]benzyl]amino]propionic acid Formula: C27H27F3N2O3 MolecularWeight: 484.51009

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=C(C=C2)CON=C(C)C3=CC=C(C=C3)CNCCC(=O)O)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=C(C=C2)CO/N=C(/C)\C3=CC=C(C=C3)CNCCC(=O)O)C(F)(F)F

InChI

InChI=1S/C27H27F3N2O3/c1-18-3-7-22(8-4-18)23-11-12-24(25(15-23)27(28,29)30)17-35-32-19(2)21-9-5-20(6-10-21)16-31-14-13-26(33)34/h3-12,15,31H,13-14,16-17H2,1-2H3,(H,33,34)/b32-19-