ethyl 2-bromanyl-3-[4-methoxy-3-[[4-(trifluoromethyl)phenyl]methylcarbamoyl]phenyl]propanoate

Systemtic Name: ethyl 2-bromanyl-3-[4-methoxy-3-[[4-(trifluoromethyl)phenyl]methylcarbamoyl]phenyl]propanoate Openeye Name: ethyl 2-bromo-3-[4-methoxy-3-[[4-(trifluoromethyl)phenyl]methylcarbamoyl]phenyl]propanoate CAS Name: 2-bromo-3-[4-methoxy-3-[oxo-[[4-(trifluoromethyl)phenyl]methylamino]methyl]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-bromo-3-[4-methoxy-3-[[4-(trifluoromethyl)phenyl]methylcarbamoyl]phenyl]propanoate Traditional Name: 2-bromo-3-[4-methoxy-3-[[4-(trifluoromethyl)benzyl]carbamoyl]phenyl]propionic acid ethyl ester Formula: C21H21BrF3NO4 MolecularWeight: 488.29495

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21BrF3NO4/c1-3-30-20(28)17(22)11-14-6-9-18(29-2)16(10-14)19(27)26-12-13-4-7-15(8-5-13)21(23,24)25/h4-10,17H,3,11-12H2,1-2H3,(H,26,27)