2-[3-bromanyl-4-[(3-propan-2-yl-1H-indol-5-yl)oxy]-5-(trifluoromethyl)phenyl]sulfanylethanoic acid

Systemtic Name: 2-[3-bromanyl-4-[(3-propan-2-yl-1H-indol-5-yl)oxy]-5-(trifluoromethyl)phenyl]sulfanylethanoic acid Openeye Name: 2-[3-bromo-4-[(3-isopropyl-1H-indol-5-yl)oxy]-5-(trifluoromethyl)phenyl]sulfanylacetic acid CAS Name: 2-[[3-bromo-4-[(3-propan-2-yl-1H-indol-5-yl)oxy]-5-(trifluoromethyl)phenyl]thio]acetic acid IUPAC Name: 2-[3-bromo-4-[(3-propan-2-yl-1H-indol-5-yl)oxy]-5-(trifluoromethyl)phenyl]sulfanylacetic acid Traditional Name: 2-[[3-bromo-4-[(3-isopropyl-1H-indol-5-yl)oxy]-5-(trifluoromethyl)phenyl]thio]acetic acid Formula: C20H17BrF3NO3S MolecularWeight: 488.31809

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3C(F)(F)F)SCC(=O)O)Br

Isomeric SMILES

CC(C)C1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3C(F)(F)F)SCC(=O)O)Br

InChI

InChI=1S/C20H17BrF3NO3S/c1-10(2)14-8-25-17-4-3-11(5-13(14)17)28-19-15(20(22,23)24)6-12(7-16(19)21)29-9-18(26)27/h3-8,10,25H,9H2,1-2H3,(H,26,27)