1-(4-methoxyphenyl)-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: 1-(4-methoxyphenyl)-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: 1-(4-methoxyphenyl)-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 1-(4-methoxyphenyl)-3-methyl-6-phenyl-4-pyrazolo[3,4-b]pyridinecarboxylate IUPAC Name: 1-(4-methoxyphenyl)-3-methyl-6-phenylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1-(4-methoxyphenyl)-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate Formula: C21H16N3O3- MolecularWeight: 358.37004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)[O-])C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)[O-])C4=CC=C(C=C4)OC

InChI

InChI=1S/C21H17N3O3/c1-13-19-17(21(25)26)12-18(14-6-4-3-5-7-14)22-20(19)24(23-13)15-8-10-16(27-2)11-9-15/h3-12H,1-2H3,(H,25,26)/p-1