dimethyl 1-(4-methylphenyl)sulfonyl-4-oxidanylidene-2H-pyrazolo[3,4-b]pyridine-5,6-dicarboxylate

Systemtic Name: dimethyl 1-(4-methylphenyl)sulfonyl-4-oxidanylidene-2H-pyrazolo[3,4-b]pyridine-5,6-dicarboxylate Openeye Name: dimethyl 4-oxo-1-(p-tolylsulfonyl)-2H-pyrazolo[3,4-b]pyridine-5,6-dicarboxylate CAS Name: 1-(4-methylphenyl)sulfonyl-4-oxo-2H-pyrazolo[3,4-b]pyridine-5,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-(4-methylphenyl)sulfonyl-4-oxo-2H-pyrazolo[3,4-b]pyridine-5,6-dicarboxylate Traditional Name: 4-keto-1-tosyl-2H-pyrazolo[3,4-b]pyridine-5,6-dicarboxylic acid dimethyl ester Formula: C17H15N3O7S MolecularWeight: 405.3819

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3=NC(=C(C(=O)C3=CN2)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C3=NC(=C(C(=O)C3=CN2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C17H15N3O7S/c1-9-4-6-10(7-5-9)28(24,25)20-15-11(8-18-20)14(21)12(16(22)26-2)13(19-15)17(23)27-3/h4-8,18H,1-3H3