methyl 3-oxidanylidene-4-[6-oxidanylidene-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]cyclohexane-1-carboxylate

Systemtic Name: methyl 3-oxidanylidene-4-[6-oxidanylidene-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]cyclohexane-1-carboxylate Openeye Name: methyl 3-oxo-4-[6-oxo-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]cyclohexanecarboxylate CAS Name: 3-oxo-4-[6-oxo-3-(2-phenyl-3-pyrazolo[1,5-a]pyridinyl)-1-pyridazinyl]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 3-oxo-4-[6-oxo-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]cyclohexane-1-carboxylate Traditional Name: 3-keto-4-[6-keto-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]cyclohexanecarboxylic acid methyl ester Formula: C25H22N4O4 MolecularWeight: 442.46658

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(C(=O)C1)N2C(=O)C=CC(=N2)C3=C4C=CC=CN4N=C3C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1CCC(C(=O)C1)N2C(=O)C=CC(=N2)C3=C4C=CC=CN4N=C3C5=CC=CC=C5

InChI

InChI=1S/C25H22N4O4/c1-33-25(32)17-10-12-19(21(30)15-17)29-22(31)13-11-18(26-29)23-20-9-5-6-14-28(20)27-24(23)16-7-3-2-4-8-16/h2-9,11,13-14,17,19H,10,12,15H2,1H3