2-[5-tert-butyl-2-[4-(trifluoromethyl)phenyl]-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-tert-butyl-2-[4-(trifluoromethyl)phenyl]-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[5-tert-butyl-2-[4-(trifluoromethyl)phenyl]-1H-indol-3-yl]acetic acid CAS Name: 2-[5-tert-butyl-2-[4-(trifluoromethyl)phenyl]-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-tert-butyl-2-[4-(trifluoromethyl)phenyl]-1H-indol-3-yl]acetic acid Traditional Name: 2-[5-tert-butyl-2-[4-(trifluoromethyl)phenyl]-1H-indol-3-yl]acetic acid Formula: C21H20F3NO2 MolecularWeight: 375.38421

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C21H20F3NO2/c1-20(2,3)14-8-9-17-15(10-14)16(11-18(26)27)19(25-17)12-4-6-13(7-5-12)21(22,23)24/h4-10,25H,11H2,1-3H3,(H,26,27)