3-(4-iodanyl-5-methyl-pyrazol-1-yl)-N-(4-methyl-2-nitro-phenyl)propanamide

Systemtic Name: 3-(4-iodanyl-5-methyl-pyrazol-1-yl)-N-(4-methyl-2-nitro-phenyl)propanamide Openeye Name: 3-(4-iodo-5-methyl-pyrazol-1-yl)-N-(4-methyl-2-nitro-phenyl)propanamide CAS Name: 3-(4-iodo-5-methyl-1-pyrazolyl)-N-(4-methyl-2-nitrophenyl)propanamide IUPAC Name: 3-(4-iodo-5-methylpyrazol-1-yl)-N-(4-methyl-2-nitrophenyl)propanamide Traditional Name: 3-(4-iodo-5-methyl-pyrazol-1-yl)-N-(4-methyl-2-nitro-phenyl)propionamide Formula: C14H15IN4O3 MolecularWeight: 414.19837

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CCN2C(=C(C=N2)I)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CCN2C(=C(C=N2)I)C)[N+](=O)[O-]

InChI

InChI=1S/C14H15IN4O3/c1-9-3-4-12(13(7-9)19(21)22)17-14(20)5-6-18-10(2)11(15)8-16-18/h3-4,7-8H,5-6H2,1-2H3,(H,17,20)