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

Systemtic Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-methyl-N-(4-phenylphenyl)propanamide Openeye Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-methyl-N-(4-phenylphenyl)propanamide CAS Name: 3-(3,5-dimethyl-4-nitro-1-pyrazolyl)-2-methyl-N-(4-phenylphenyl)propanamide IUPAC Name: 3-(3,5-dimethyl-4-nitropyrazol-1-yl)-2-methyl-N-(4-phenylphenyl)propanamide Traditional Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-methyl-N-(4-phenylphenyl)propionamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C(=O)NC2=CC=C(C=C2)C3=CC=CC=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(C)C(=O)NC2=CC=C(C=C2)C3=CC=CC=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O3/c1-14(13-24-16(3)20(25(27)28)15(2)23-24)21(26)22-19-11-9-18(10-12-19)17-7-5-4-6-8-17/h4-12,14H,13H2,1-3H3,(H,22,26)