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

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(2-iodanylphenyl)benzamide Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(2-iodophenyl)benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-(2-iodophenyl)benzamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-(2-iodophenyl)benzamide Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(2-iodophenyl)benzamide Formula: C19H17IN4O3 MolecularWeight: 476.26775

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3I)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3I)C)[N+](=O)[O-]

InChI

InChI=1S/C19H17IN4O3/c1-12-18(24(26)27)13(2)23(22-12)11-14-7-9-15(10-8-14)19(25)21-17-6-4-3-5-16(17)20/h3-10H,11H2,1-2H3,(H,21,25)