[2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-6-yl]-(5-nitro-2-oxidanyl-phenyl)methanone

Systemtic Name: [2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-6-yl]-(5-nitro-2-oxidanyl-phenyl)methanone Openeye Name: (2-hydroxy-5-nitro-phenyl)-[2-(p-tolyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanone CAS Name: (2-hydroxy-5-nitrophenyl)-[2-(4-methylphenyl)-6-pyrazolo[1,5-a]pyrimidinyl]methanone IUPAC Name: (2-hydroxy-5-nitrophenyl)-[2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanone Traditional Name: (2-hydroxy-5-nitro-phenyl)-[2-(p-tolyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanone Formula: C20H14N4O4 MolecularWeight: 374.34956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN3C=C(C=NC3=C2)C(=O)C4=C(C=CC(=C4)[N+](=O)[O-])O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN3C=C(C=NC3=C2)C(=O)C4=C(C=CC(=C4)[N+](=O)[O-])O

InChI

InChI=1S/C20H14N4O4/c1-12-2-4-13(5-3-12)17-9-19-21-10-14(11-23(19)22-17)20(26)16-8-15(24(27)28)6-7-18(16)25/h2-11,25H,1H3