3-(4-methoxyphenyl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylic acid

Systemtic Name: 3-(4-methoxyphenyl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylic acid Openeye Name: 3-(4-methoxyphenyl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylic acid CAS Name: 3-(4-methoxyphenyl)-1-[[3-(trifluoromethyl)phenyl]methyl]-2-indolecarboxylic acid IUPAC Name: 3-(4-methoxyphenyl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylic acid Traditional Name: 3-(4-methoxyphenyl)-1-[3-(trifluoromethyl)benzyl]indole-2-carboxylic acid Formula: C24H18F3NO3 MolecularWeight: 425.39983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(N(C3=CC=CC=C32)CC4=CC(=CC=C4)C(F)(F)F)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(N(C3=CC=CC=C32)CC4=CC(=CC=C4)C(F)(F)F)C(=O)O

InChI

InChI=1S/C24H18F3NO3/c1-31-18-11-9-16(10-12-18)21-19-7-2-3-8-20(19)28(22(21)23(29)30)14-15-5-4-6-17(13-15)24(25,26)27/h2-13H,14H2,1H3,(H,29,30)