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

Systemtic Name: ethyl 2-methyl-2-(4-methyl-7-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)propanoate Openeye Name: ethyl 2-methyl-2-(4-methyl-7-oxo-1-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)propanoate CAS Name: 2-methyl-2-(4-methyl-7-oxo-1-phenyl-6-pyrazolo[3,4-d]pyridazinyl)propanoic acid ethyl ester IUPAC Name: ethyl 2-methyl-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)-2-methyl-propionic acid ethyl ester Formula: C18H20N4O3 MolecularWeight: 340.3764

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N4O3/c1-5-25-17(24)18(3,4)22-16(23)15-14(12(2)20-22)11-19-21(15)13-9-7-6-8-10-13/h6-11H,5H2,1-4H3