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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C(=O)C2=NN(C(=C2C(=N1)C)C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CCN1C(=O)C2=NN(C(=C2C(=N1)C)C)C3=CC=CC=C3

InChI

InChI=1S/C18H20N4O3/c1-4-25-15(23)10-11-21-18(24)17-16(12(2)19-21)13(3)22(20-17)14-8-6-5-7-9-14/h5-9H,4,10-11H2,1-3H3