3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(4-ethanoylphenyl)-2-methyl-propanamide

Systemtic Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(4-ethanoylphenyl)-2-methyl-propanamide Openeye Name: N-(4-acetylphenyl)-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-methyl-propanamide CAS Name: N-(4-acetylphenyl)-3-(3,5-dimethyl-4-nitro-1-pyrazolyl)-2-methylpropanamide IUPAC Name: N-(4-acetylphenyl)-3-(3,5-dimethyl-4-nitropyrazol-1-yl)-2-methylpropanamide Traditional Name: N-(4-acetylphenyl)-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-methyl-propionamide Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C(=O)NC2=CC=C(C=C2)C(=O)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(C)C(=O)NC2=CC=C(C=C2)C(=O)C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O4/c1-10(9-20-12(3)16(21(24)25)11(2)19-20)17(23)18-15-7-5-14(6-8-15)13(4)22/h5-8,10H,9H2,1-4H3,(H,18,23)