3-methyl-4-(4-nitrophenyl)-6-phenacyloxy-1-phenyl-pyrazolo[3,4-b]pyridine-5-carbonitrile

Systemtic Name: 3-methyl-4-(4-nitrophenyl)-6-phenacyloxy-1-phenyl-pyrazolo[3,4-b]pyridine-5-carbonitrile Openeye Name: 3-methyl-4-(4-nitrophenyl)-6-phenacyloxy-1-phenyl-pyrazolo[3,4-b]pyridine-5-carbonitrile CAS Name: 3-methyl-4-(4-nitrophenyl)-6-phenacyloxy-1-phenyl-5-pyrazolo[3,4-b]pyridinecarbonitrile IUPAC Name: 3-methyl-4-(4-nitrophenyl)-6-phenacyloxy-1-phenylpyrazolo[3,4-b]pyridine-5-carbonitrile Traditional Name: 3-methyl-4-(4-nitrophenyl)-6-phenacyloxy-1-phenyl-pyrazolo[3,4-b]pyridine-5-carbonitrile Formula: C28H19N5O4 MolecularWeight: 489.48156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H19N5O4/c1-18-25-26(20-12-14-22(15-13-20)33(35)36)23(16-29)28(37-17-24(34)19-8-4-2-5-9-19)30-27(25)32(31-18)21-10-6-3-7-11-21/h2-15H,17H2,1H3