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

Systemtic Name: (4-nitrophenyl)methyl 6-(4-methoxyphenyl)-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: (4-nitrophenyl)methyl 6-(4-methoxyphenyl)-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 6-(4-methoxyphenyl)-3-methyl-1-phenyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 6-(4-methoxyphenyl)-3-methyl-1-phenylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 6-(4-methoxyphenyl)-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid (4-nitrobenzyl) ester Formula: C28H22N4O5 MolecularWeight: 494.49808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=C(C=C3)OC)C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=C(C=C3)OC)C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C28H22N4O5/c1-18-26-24(28(33)37-17-19-8-12-22(13-9-19)32(34)35)16-25(20-10-14-23(36-2)15-11-20)29-27(26)31(30-18)21-6-4-3-5-7-21/h3-16H,17H2,1-2H3