(2-chloranyl-4-nitro-phenyl) 3-methyl-1,6-diphenyl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: (2-chloranyl-4-nitro-phenyl) 3-methyl-1,6-diphenyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: (2-chloro-4-nitro-phenyl) 3-methyl-1,6-diphenyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 3-methyl-1,6-diphenyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid (2-chloro-4-nitrophenyl) ester IUPAC Name: (2-chloro-4-nitrophenyl) 3-methyl-1,6-diphenylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 3-methyl-1,6-diphenyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid (2-chloro-4-nitro-phenyl) ester Formula: C26H17ClN4O4 MolecularWeight: 484.89058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)OC4=C(C=C(C=C4)[N+](=O)[O-])Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)OC4=C(C=C(C=C4)[N+](=O)[O-])Cl)C5=CC=CC=C5

InChI

InChI=1S/C26H17ClN4O4/c1-16-24-20(26(32)35-23-13-12-19(31(33)34)14-21(23)27)15-22(17-8-4-2-5-9-17)28-25(24)30(29-16)18-10-6-3-7-11-18/h2-15H,1H3