methyl 3-[2-methyl-6-oxidanylidene-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-7-yl]propanoate

Systemtic Name: methyl 3-[2-methyl-6-oxidanylidene-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-7-yl]propanoate Openeye Name: methyl 3-[2-methyl-6-oxo-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-7-yl]propanoate CAS Name: 3-[2-methyl-6-oxo-4-(trifluoromethyl)-7-pyrazolo[3,4-b]pyridinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-methyl-6-oxo-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-7-yl]propanoate Traditional Name: 3-[6-keto-2-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-7-yl]propionic acid methyl ester Formula: C12H12F3N3O3 MolecularWeight: 303.23719

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C2C(=CC(=O)N(C2=N1)CCC(=O)OC)C(F)(F)F

Isomeric SMILES

CN1C=C2C(=CC(=O)N(C2=N1)CCC(=O)OC)C(F)(F)F

InChI

InChI=1S/C12H12F3N3O3/c1-17-6-7-8(12(13,14)15)5-9(19)18(11(7)16-17)4-3-10(20)21-2/h5-6H,3-4H2,1-2H3