[3-methyl-1-(4-nitrophenyl)pyrazolo[3,4-b]pyridin-5-yl]-(5-methyl-2-oxidanyl-phenyl)methanone

Systemtic Name: [3-methyl-1-(4-nitrophenyl)pyrazolo[3,4-b]pyridin-5-yl]-(5-methyl-2-oxidanyl-phenyl)methanone Openeye Name: (2-hydroxy-5-methyl-phenyl)-[3-methyl-1-(4-nitrophenyl)pyrazolo[3,4-b]pyridin-5-yl]methanone CAS Name: (2-hydroxy-5-methylphenyl)-[3-methyl-1-(4-nitrophenyl)-5-pyrazolo[3,4-b]pyridinyl]methanone IUPAC Name: (2-hydroxy-5-methylphenyl)-[3-methyl-1-(4-nitrophenyl)pyrazolo[3,4-b]pyridin-5-yl]methanone Traditional Name: (2-hydroxy-5-methyl-phenyl)-[3-methyl-1-(4-nitrophenyl)pyrazolo[3,4-b]pyridin-5-yl]methanone Formula: C21H16N4O4 MolecularWeight: 388.37614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C(=O)C2=CN=C3C(=C2)C(=NN3C4=CC=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)O)C(=O)C2=CN=C3C(=C2)C(=NN3C4=CC=C(C=C4)[N+](=O)[O-])C

InChI

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