3-[5-(trifluoromethyl)-1H-indol-3-yl]propanoic acid

Systemtic Name: 3-[5-(trifluoromethyl)-1H-indol-3-yl]propanoic acid Openeye Name: 3-[5-(trifluoromethyl)-1H-indol-3-yl]propanoic acid CAS Name: 3-[5-(trifluoromethyl)-1H-indol-3-yl]propanoic acid IUPAC Name: 3-[5-(trifluoromethyl)-1H-indol-3-yl]propanoic acid Traditional Name: 3-[5-(trifluoromethyl)-1H-indol-3-yl]propionic acid Formula: C12H10F3NO2 MolecularWeight: 257.20851

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(F)(F)F)C(=CN2)CCC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1C(F)(F)F)C(=CN2)CCC(=O)O

InChI

InChI=1S/C12H10F3NO2/c13-12(14,15)8-2-3-10-9(5-8)7(6-16-10)1-4-11(17)18/h2-3,5-6,16H,1,4H2,(H,17,18)