3-[3-methyl-4,6-bis(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]propanenitrile

Systemtic Name: 3-[3-methyl-4,6-bis(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]propanenitrile Openeye Name: 3-[3-methyl-4,6-bis(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]propanenitrile CAS Name: 3-[3-methyl-4,6-bis(trifluoromethyl)-1-pyrazolo[3,4-b]pyridinyl]propanenitrile IUPAC Name: 3-[3-methyl-4,6-bis(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]propanenitrile Traditional Name: 3-[3-methyl-4,6-bis(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]propionitrile Formula: C12H8F6N4 MolecularWeight: 322.209139

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C(F)(F)F)C(F)(F)F)CCC#N

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C(F)(F)F)C(F)(F)F)CCC#N

InChI

InChI=1S/C12H8F6N4/c1-6-9-7(11(13,14)15)5-8(12(16,17)18)20-10(9)22(21-6)4-2-3-19/h5H,2,4H2,1H3