5-methyl-2-(4-nitrophenyl)-4,4-bis(oxidanyl)pyrazol-3-one

Systemtic Name: 5-methyl-2-(4-nitrophenyl)-4,4-bis(oxidanyl)pyrazol-3-one Openeye Name: 4,4-dihydroxy-5-methyl-2-(4-nitrophenyl)pyrazol-3-one CAS Name: 4,4-dihydroxy-5-methyl-2-(4-nitrophenyl)-3-pyrazolone IUPAC Name: 4,4-dihydroxy-5-methyl-2-(4-nitrophenyl)pyrazol-3-one Traditional Name: 4,4-dihydroxy-5-methyl-2-(4-nitrophenyl)-2-pyrazolin-3-one Formula: C10H9N3O5 MolecularWeight: 251.19556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1(O)O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C(=O)C1(O)O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C10H9N3O5/c1-6-10(15,16)9(14)12(11-6)7-2-4-8(5-3-7)13(17)18/h2-5,15-16H,1H3