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

Systemtic Name: methyl 3-methyl-6-(3-nitrophenyl)-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: methyl 3-methyl-6-(3-nitrophenyl)-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 3-methyl-6-(3-nitrophenyl)-1-phenyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-methyl-6-(3-nitrophenyl)-1-phenylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 3-methyl-6-(3-nitrophenyl)-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid methyl ester Formula: C21H16N4O4 MolecularWeight: 388.37614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16N4O4/c1-13-19-17(21(26)29-2)12-18(14-7-6-10-16(11-14)25(27)28)22-20(19)24(23-13)15-8-4-3-5-9-15/h3-12H,1-2H3