ethyl 2-(4-methyl-7-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)propanoate

Systemtic Name: ethyl 2-(4-methyl-7-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)propanoate Openeye Name: ethyl 2-(4-methyl-7-oxo-1-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)propanoate CAS Name: 2-(4-methyl-7-oxo-1-phenyl-6-pyrazolo[3,4-d]pyridazinyl)propanoic acid ethyl ester IUPAC Name: ethyl 2-(4-methyl-7-oxo-1-phenylpyrazolo[3,4-d]pyridazin-6-yl)propanoate Traditional Name: 2-(7-keto-4-methyl-1-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)propionic acid ethyl ester Formula: C17H18N4O3 MolecularWeight: 326.34982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)N1C(=O)C2=C(C=NN2C3=CC=CC=C3)C(=N1)C

Isomeric SMILES

CCOC(=O)C(C)N1C(=O)C2=C(C=NN2C3=CC=CC=C3)C(=N1)C

InChI

InChI=1S/C17H18N4O3/c1-4-24-17(23)12(3)20-16(22)15-14(11(2)19-20)10-18-21(15)13-8-6-5-7-9-13/h5-10,12H,4H2,1-3H3