6-[(4R)-4-(3-methoxy-4-prop-2-ynoxy-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-prop-2-ynoxy-phenyl)-3-methyl-6-oxidanylidene-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-1-yl]pyridazin-3-olate Openeye Name: 6-[(4R)-4-(3-methoxy-4-prop-2-ynoxy-phenyl)-3-methyl-6-oxo-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-1-yl]pyridazin-3-olate CAS Name: 6-[(4R)-4-(3-methoxy-4-prop-2-ynoxyphenyl)-3-methyl-6-oxo-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-1-yl]-3-pyridazinolate IUPAC Name: 6-[(4R)-4-(3-methoxy-4-prop-2-ynoxyphenyl)-3-methyl-6-oxo-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-1-yl]pyridazin-3-olate Traditional Name: 6-[(4R)-6-keto-4-(3-methoxy-4-propargyloxy-phenyl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-1-yl]pyridazin-3-olate Formula: C21H18N5O4- MolecularWeight: 404.39872

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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)OCC#C)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H19N5O4/c1-4-9-30-15-6-5-13(10-16(15)29-3)14-11-19(28)22-21-20(14)12(2)25-26(21)17-7-8-18(27)24-23-17/h1,5-8,10,14,25H,9,11H2,2-3H3,(H,24,27)/p-1/t14-/m1/s1