4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(2-propan-2-ylphenyl)benzamide

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(2-propan-2-ylphenyl)benzamide Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(2-isopropylphenyl)benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-(2-propan-2-ylphenyl)benzamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-(2-propan-2-ylphenyl)benzamide Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-o-cumenyl-benzamide Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(C)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(C)C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O3/c1-14(2)19-7-5-6-8-20(19)23-22(27)18-11-9-17(10-12-18)13-25-16(4)21(26(28)29)15(3)24-25/h5-12,14H,13H2,1-4H3,(H,23,27)