3-methyl-2-(2-nitro-4-oxidanyl-phenyl)-1H-pyrazol-5-one

Systemtic Name: 3-methyl-2-(2-nitro-4-oxidanyl-phenyl)-1H-pyrazol-5-one Openeye Name: 2-(4-hydroxy-2-nitro-phenyl)-3-methyl-1H-pyrazol-5-one CAS Name: 2-(4-hydroxy-2-nitrophenyl)-3-methyl-1H-pyrazol-5-one IUPAC Name: 2-(4-hydroxy-2-nitrophenyl)-3-methyl-1H-pyrazol-5-one Traditional Name: 1-(4-hydroxy-2-nitro-phenyl)-5-methyl-3-pyrazolin-3-one Formula: C10H9N3O4 MolecularWeight: 235.19616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)NN1C2=C(C=C(C=C2)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)NN1C2=C(C=C(C=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C10H9N3O4/c1-6-4-10(15)11-12(6)8-3-2-7(14)5-9(8)13(16)17/h2-5,14H,1H3,(H,11,15)