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

Systemtic Name: 3-methyl-6-phenyl-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: 1-benzyl-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 3-methyl-6-phenyl-1-(phenylmethyl)-4-pyrazolo[3,4-b]pyridinecarboxylate IUPAC Name: 1-benzyl-3-methyl-6-phenylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1-benzyl-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate Formula: C21H16N3O2- MolecularWeight: 342.37064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)[O-])CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)[O-])CC4=CC=CC=C4

InChI

InChI=1S/C21H17N3O2/c1-14-19-17(21(25)26)12-18(16-10-6-3-7-11-16)22-20(19)24(23-14)13-15-8-4-2-5-9-15/h2-12H,13H2,1H3,(H,25,26)/p-1