3-[5-methoxy-1-[[2-(trifluoromethyloxy)phenyl]methyl]indol-3-yl]propanoic acid

Systemtic Name: 3-[5-methoxy-1-[[2-(trifluoromethyloxy)phenyl]methyl]indol-3-yl]propanoic acid Openeye Name: 3-[5-methoxy-1-[[2-(trifluoromethoxy)phenyl]methyl]indol-3-yl]propanoic acid CAS Name: 3-[5-methoxy-1-[[2-(trifluoromethoxy)phenyl]methyl]-3-indolyl]propanoic acid IUPAC Name: 3-[5-methoxy-1-[[2-(trifluoromethoxy)phenyl]methyl]indol-3-yl]propanoic acid Traditional Name: 3-[5-methoxy-1-[2-(trifluoromethoxy)benzyl]indol-3-yl]propionic acid Formula: C20H18F3NO4 MolecularWeight: 393.35643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C=C2CCC(=O)O)CC3=CC=CC=C3OC(F)(F)F

Isomeric SMILES

COC1=CC2=C(C=C1)N(C=C2CCC(=O)O)CC3=CC=CC=C3OC(F)(F)F

InChI

InChI=1S/C20H18F3NO4/c1-27-15-7-8-17-16(10-15)13(6-9-19(25)26)11-24(17)12-14-4-2-3-5-18(14)28-20(21,22)23/h2-5,7-8,10-11H,6,9,12H2,1H3,(H,25,26)