methyl 4-[3-methyl-6-oxidanylidene-1-(6-oxidanylidene-1H-pyridazin-3-yl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl]benzoate

Systemtic Name: methyl 4-[3-methyl-6-oxidanylidene-1-(6-oxidanylidene-1H-pyridazin-3-yl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl]benzoate Openeye Name: methyl 4-[3-methyl-6-oxo-1-(6-oxo-1H-pyridazin-3-yl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl]benzoate CAS Name: 4-[3-methyl-6-oxo-1-(6-oxo-1H-pyridazin-3-yl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-methyl-6-oxo-1-(6-oxo-1H-pyridazin-3-yl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl]benzoate Traditional Name: 4-[6-keto-1-(6-keto-1H-pyridazin-3-yl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl]benzoic acid methyl ester Formula: C19H17N5O4 MolecularWeight: 379.36938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(CC(=O)N=C2N(N1)C3=NNC(=O)C=C3)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=C2C(CC(=O)N=C2N(N1)C3=NNC(=O)C=C3)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C19H17N5O4/c1-10-17-13(11-3-5-12(6-4-11)19(27)28-2)9-16(26)20-18(17)24(23-10)14-7-8-15(25)22-21-14/h3-8,13,23H,9H2,1-2H3,(H,22,25)