1-(4-propan-2-yloxyphenyl)-5-[4-(trifluoromethyl)phenoxy]indole-2-carboxylic acid

Systemtic Name: 1-(4-propan-2-yloxyphenyl)-5-[4-(trifluoromethyl)phenoxy]indole-2-carboxylic acid Openeye Name: 1-(4-isopropoxyphenyl)-5-[4-(trifluoromethyl)phenoxy]indole-2-carboxylic acid CAS Name: 1-(4-propan-2-yloxyphenyl)-5-[4-(trifluoromethyl)phenoxy]-2-indolecarboxylic acid IUPAC Name: 1-(4-propan-2-yloxyphenyl)-5-[4-(trifluoromethyl)phenoxy]indole-2-carboxylic acid Traditional Name: 1-(4-isopropoxyphenyl)-5-[4-(trifluoromethyl)phenoxy]indole-2-carboxylic acid Formula: C25H20F3NO4 MolecularWeight: 455.42581

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)N2C3=C(C=C(C=C3)OC4=CC=C(C=C4)C(F)(F)F)C=C2C(=O)O

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)N2C3=C(C=C(C=C3)OC4=CC=C(C=C4)C(F)(F)F)C=C2C(=O)O

InChI

InChI=1S/C25H20F3NO4/c1-15(2)32-19-9-5-18(6-10-19)29-22-12-11-21(13-16(22)14-23(29)24(30)31)33-20-7-3-17(4-8-20)25(26,27)28/h3-15H,1-2H3,(H,30,31)