2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-(3,4-dimethylphenyl)propan-1-one

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-(3,4-dimethylphenyl)propan-1-one Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-(3,4-dimethylphenyl)propan-1-one CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-(3,4-dimethylphenyl)-1-propanone IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-1-(3,4-dimethylphenyl)propan-1-one Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-(3,4-dimethylphenyl)propan-1-one Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O3/c1-9-6-7-14(8-10(9)2)16(20)13(5)18-12(4)15(19(21)22)11(3)17-18/h6-8,13H,1-5H3