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

Systemtic Name: (5-bromanyl-2-oxidanyl-phenyl)-[3-methyl-1-(4-nitrophenyl)pyrazolo[3,4-b]pyridin-5-yl]methanone Openeye Name: (5-bromo-2-hydroxy-phenyl)-[3-methyl-1-(4-nitrophenyl)pyrazolo[3,4-b]pyridin-5-yl]methanone CAS Name: (5-bromo-2-hydroxyphenyl)-[3-methyl-1-(4-nitrophenyl)-5-pyrazolo[3,4-b]pyridinyl]methanone IUPAC Name: (5-bromo-2-hydroxyphenyl)-[3-methyl-1-(4-nitrophenyl)pyrazolo[3,4-b]pyridin-5-yl]methanone Traditional Name: (5-bromo-2-hydroxy-phenyl)-[3-methyl-1-(4-nitrophenyl)pyrazolo[3,4-b]pyridin-5-yl]methanone Formula: C20H13BrN4O4 MolecularWeight: 453.24562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C=C12)C(=O)C3=C(C=CC(=C3)Br)O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C2=NC=C(C=C12)C(=O)C3=C(C=CC(=C3)Br)O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H13BrN4O4/c1-11-16-8-12(19(27)17-9-13(21)2-7-18(17)26)10-22-20(16)24(23-11)14-3-5-15(6-4-14)25(28)29/h2-10,26H,1H3