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

Systemtic Name: methyl 3-[6-oxidanylidene-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]cyclohexane-1-carboxylate Openeye Name: methyl 3-[6-oxo-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]cyclohexanecarboxylate CAS Name: 3-[6-oxo-3-(2-phenyl-3-pyrazolo[1,5-a]pyridinyl)-1-pyridazinyl]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 3-[6-oxo-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]cyclohexane-1-carboxylate Traditional Name: 3-[6-keto-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]cyclohexanecarboxylic acid methyl ester Formula: C25H24N4O3 MolecularWeight: 428.48306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCC(C1)N2C(=O)C=CC(=N2)C3=C4C=CC=CN4N=C3C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1CCCC(C1)N2C(=O)C=CC(=N2)C3=C4C=CC=CN4N=C3C5=CC=CC=C5

InChI

InChI=1S/C25H24N4O3/c1-32-25(31)18-10-7-11-19(16-18)29-22(30)14-13-20(26-29)23-21-12-5-6-15-28(21)27-24(23)17-8-3-2-4-9-17/h2-6,8-9,12-15,18-19H,7,10-11,16H2,1H3