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

Systemtic Name: 3-[3-methyl-6-oxidanylidene-4-(trifluoromethyl)-3aH-pyrazolo[3,4-b]pyridin-1-yl]propanenitrile Openeye Name: 3-[3-methyl-6-oxo-4-(trifluoromethyl)-3aH-pyrazolo[3,4-b]pyridin-1-yl]propanenitrile CAS Name: 3-[3-methyl-6-oxo-4-(trifluoromethyl)-3aH-pyrazolo[3,4-b]pyridin-1-yl]propanenitrile IUPAC Name: 3-[3-methyl-6-oxo-4-(trifluoromethyl)-3aH-pyrazolo[3,4-b]pyridin-1-yl]propanenitrile Traditional Name: 3-[6-keto-3-methyl-4-(trifluoromethyl)-3aH-pyrazolo[3,4-b]pyridin-1-yl]propionitrile Formula: C11H9F3N4O MolecularWeight: 270.21057

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC(=O)C=C(C12)C(F)(F)F)CCC#N

Isomeric SMILES

CC1=NN(C2=NC(=O)C=C(C12)C(F)(F)F)CCC#N

InChI

InChI=1S/C11H9F3N4O/c1-6-9-7(11(12,13)14)5-8(19)16-10(9)18(17-6)4-2-3-15/h5,9H,2,4H2,1H3