6-[(4R)-4-(3-methoxy-4-oxidanyl-phenyl)-3-methyl-6-oxidanylidene-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-1-yl]pyridazin-3-olate

Systemtic Name: 6-[(4R)-4-(3-methoxy-4-oxidanyl-phenyl)-3-methyl-6-oxidanylidene-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-1-yl]pyridazin-3-olate Openeye Name: 6-[(4R)-4-(4-hydroxy-3-methoxy-phenyl)-3-methyl-6-oxo-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-1-yl]pyridazin-3-olate CAS Name: 6-[(4R)-4-(4-hydroxy-3-methoxyphenyl)-3-methyl-6-oxo-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-1-yl]-3-pyridazinolate IUPAC Name: 6-[(4R)-4-(4-hydroxy-3-methoxyphenyl)-3-methyl-6-oxo-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-1-yl]pyridazin-3-olate Traditional Name: 6-[(4R)-4-(4-hydroxy-3-methoxy-phenyl)-6-keto-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-1-yl]pyridazin-3-olate Formula: C18H16N5O4- MolecularWeight: 366.35074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(CC(=O)N=C2N(N1)C3=NN=C(C=C3)[O-])C4=CC(=C(C=C4)O)OC

Isomeric SMILES

CC1=C2[C@H](CC(=O)N=C2N(N1)C3=NN=C(C=C3)[O-])C4=CC(=C(C=C4)O)OC

InChI

InChI=1S/C18H17N5O4/c1-9-17-11(10-3-4-12(24)13(7-10)27-2)8-16(26)19-18(17)23(22-9)14-5-6-15(25)21-20-14/h3-7,11,22,24H,8H2,1-2H3,(H,21,25)/p-1/t11-/m1/s1