N-(4-iodanyl-2-methyl-phenyl)-2-(4-nitropyrazol-1-yl)ethanamide

Systemtic Name: N-(4-iodanyl-2-methyl-phenyl)-2-(4-nitropyrazol-1-yl)ethanamide Openeye Name: N-(4-iodo-2-methyl-phenyl)-2-(4-nitropyrazol-1-yl)acetamide CAS Name: N-(4-iodo-2-methylphenyl)-2-(4-nitro-1-pyrazolyl)acetamide IUPAC Name: N-(4-iodo-2-methylphenyl)-2-(4-nitropyrazol-1-yl)acetamide Traditional Name: N-(4-iodo-2-methyl-phenyl)-2-(4-nitropyrazol-1-yl)acetamide Formula: C12H11IN4O3 MolecularWeight: 386.14521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=O)CN2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=O)CN2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C12H11IN4O3/c1-8-4-9(13)2-3-11(8)15-12(18)7-16-6-10(5-14-16)17(19)20/h2-6H,7H2,1H3,(H,15,18)