N-(4-iodophenyl)-2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)ethanamide

Systemtic Name: N-(4-iodophenyl)-2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)ethanamide Openeye Name: N-(4-iodophenyl)-2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)acetamide CAS Name: N-(4-iodophenyl)-2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)acetamide IUPAC Name: N-(4-iodophenyl)-2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)acetamide Traditional Name: N-(4-iodophenyl)-2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)acetamide Formula: C11H10IN5O3 MolecularWeight: 387.13327

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10IN5O3/c1-7-13-11(17(19)20)15-16(7)6-10(18)14-9-4-2-8(12)3-5-9/h2-5H,6H2,1H3,(H,14,18)