methyl 3-[6-oxidanylidene-5-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]propanoate

Systemtic Name: methyl 3-[6-oxidanylidene-5-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]propanoate Openeye Name: methyl 3-[6-oxo-5-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]propanoate CAS Name: 3-[6-oxo-5-(2-phenyl-3-pyrazolo[1,5-a]pyridinyl)-1-pyridazinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[6-oxo-5-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]propanoate Traditional Name: 3-[6-keto-5-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]propionic acid methyl ester Formula: C21H18N4O3 MolecularWeight: 374.39262

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C(=O)C(=CC=N1)C2=C3C=CC=CN3N=C2C4=CC=CC=C4

Isomeric SMILES

COC(=O)CCN1C(=O)C(=CC=N1)C2=C3C=CC=CN3N=C2C4=CC=CC=C4

InChI

InChI=1S/C21H18N4O3/c1-28-18(26)11-14-25-21(27)16(10-12-22-25)19-17-9-5-6-13-24(17)23-20(19)15-7-3-2-4-8-15/h2-10,12-13H,11,14H2,1H3