2-(3-iodanyl-1,2,4-triazol-1-yl)-1-(4-methylphenyl)ethanone

Systemtic Name: 2-(3-iodanyl-1,2,4-triazol-1-yl)-1-(4-methylphenyl)ethanone Openeye Name: 2-(3-iodo-1,2,4-triazol-1-yl)-1-(p-tolyl)ethanone CAS Name: 2-(3-iodo-1,2,4-triazol-1-yl)-1-(4-methylphenyl)ethanone IUPAC Name: 2-(3-iodo-1,2,4-triazol-1-yl)-1-(4-methylphenyl)ethanone Traditional Name: 2-(3-iodo-1,2,4-triazol-1-yl)-1-(p-tolyl)ethanone Formula: C11H10IN3O MolecularWeight: 327.12107

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CN2C=NC(=N2)I

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CN2C=NC(=N2)I

InChI

InChI=1S/C11H10IN3O/c1-8-2-4-9(5-3-8)10(16)6-15-7-13-11(12)14-15/h2-5,7H,6H2,1H3