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

Systemtic Name: 3-methyl-2-(5-methyl-2-nitro-phenyl)-1H-pyrazol-5-one Openeye Name: 3-methyl-2-(5-methyl-2-nitro-phenyl)-1H-pyrazol-5-one CAS Name: 3-methyl-2-(5-methyl-2-nitrophenyl)-1H-pyrazol-5-one IUPAC Name: 3-methyl-2-(5-methyl-2-nitrophenyl)-1H-pyrazol-5-one Traditional Name: 5-methyl-1-(5-methyl-2-nitro-phenyl)-3-pyrazolin-3-one Formula: C11H11N3O3 MolecularWeight: 233.22334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])N2C(=CC(=O)N2)C

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])N2C(=CC(=O)N2)C

InChI

InChI=1S/C11H11N3O3/c1-7-3-4-9(14(16)17)10(5-7)13-8(2)6-11(15)12-13/h3-6H,1-2H3,(H,12,15)