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

Systemtic Name: 2-(4-methoxy-2-nitro-phenyl)-3-methyl-1H-pyrazol-5-one Openeye Name: 2-(4-methoxy-2-nitro-phenyl)-3-methyl-1H-pyrazol-5-one CAS Name: 2-(4-methoxy-2-nitrophenyl)-3-methyl-1H-pyrazol-5-one IUPAC Name: 2-(4-methoxy-2-nitrophenyl)-3-methyl-1H-pyrazol-5-one Traditional Name: 1-(4-methoxy-2-nitro-phenyl)-5-methyl-3-pyrazolin-3-one Formula: C11H11N3O4 MolecularWeight: 249.22274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11N3O4/c1-7-5-11(15)12-13(7)9-4-3-8(18-2)6-10(9)14(16)17/h3-6H,1-2H3,(H,12,15)