diethyl 2-[2-[3-(dimethylcarbamoyl)-4-[[3-methoxy-2-[4-(trifluoromethyl)phenyl]phenyl]carbonylamino]phenyl]ethanoyloxymethyl]-2-phenyl-propanedioate

Systemtic Name: diethyl 2-[2-[3-(dimethylcarbamoyl)-4-[[3-methoxy-2-[4-(trifluoromethyl)phenyl]phenyl]carbonylamino]phenyl]ethanoyloxymethyl]-2-phenyl-propanedioate Openeye Name: diethyl 2-[[2-[3-(dimethylcarbamoyl)-4-[[3-methoxy-2-[4-(trifluoromethyl)phenyl]benzoyl]amino]phenyl]acetyl]oxymethyl]-2-phenyl-propanedioate CAS Name: 2-[[2-[3-[dimethylamino(oxo)methyl]-4-[[[3-methoxy-2-[4-(trifluoromethyl)phenyl]phenyl]-oxomethyl]amino]phenyl]-1-oxoethoxy]methyl]-2-phenylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-[[2-[3-(dimethylcarbamoyl)-4-[[3-methoxy-2-[4-(trifluoromethyl)phenyl]benzoyl]amino]phenyl]acetyl]oxymethyl]-2-phenylpropanedioate Traditional Name: 2-[[2-[3-(dimethylcarbamoyl)-4-[[3-methoxy-2-[4-(trifluoromethyl)phenyl]benzoyl]amino]phenyl]acetyl]oxymethyl]-2-phenyl-malonic acid diethyl ester Formula: C40H39F3N2O9 MolecularWeight: 748.74087

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(COC(=O)CC1=CC(=C(C=C1)NC(=O)C2=C(C(=CC=C2)OC)C3=CC=C(C=C3)C(F)(F)F)C(=O)N(C)C)(C4=CC=CC=C4)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(COC(=O)CC1=CC(=C(C=C1)NC(=O)C2=C(C(=CC=C2)OC)C3=CC=C(C=C3)C(F)(F)F)C(=O)N(C)C)(C4=CC=CC=C4)C(=O)OCC

InChI

InChI=1S/C40H39F3N2O9/c1-6-52-37(49)39(38(50)53-7-2,27-12-9-8-10-13-27)24-54-33(46)23-25-16-21-31(30(22-25)36(48)45(3)4)44-35(47)29-14-11-15-32(51-5)34(29)26-17-19-28(20-18-26)40(41,42)43/h8-22H,6-7,23-24H2,1-5H3,(H,44,47)