3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[2-(phenylcarbonyl)phenyl]propanamide

Systemtic Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[2-(phenylcarbonyl)phenyl]propanamide Openeye Name: N-(2-benzoylphenyl)-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-(2-benzoylphenyl)-3-(3,5-dimethyl-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(2-benzoylphenyl)-3-(3,5-dimethyl-4-nitropyrazol-1-yl)propanamide Traditional Name: N-(2-benzoylphenyl)-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propionamide Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)NC2=CC=CC=C2C(=O)C3=CC=CC=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)NC2=CC=CC=C2C(=O)C3=CC=CC=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O4/c1-14-20(25(28)29)15(2)24(23-14)13-12-19(26)22-18-11-7-6-10-17(18)21(27)16-8-4-3-5-9-16/h3-11H,12-13H2,1-2H3,(H,22,26)