1-(2,4-dichlorophenyl)-2-(4-ethyl-1,2,4-triazol-4-ium-1-yl)ethanone iodide

Systemtic Name: 1-(2,4-dichlorophenyl)-2-(4-ethyl-1,2,4-triazol-4-ium-1-yl)ethanone iodide Openeye Name: 1-(2,4-dichlorophenyl)-2-(4-ethyl-1,2,4-triazol-4-ium-1-yl)ethanone iodide CAS Name: 1-(2,4-dichlorophenyl)-2-(4-ethyl-1,2,4-triazol-4-ium-1-yl)ethanone iodide IUPAC Name: 1-(2,4-dichlorophenyl)-2-(4-ethyl-1,2,4-triazol-4-ium-1-yl)ethanone iodide Traditional Name: 1-(2,4-dichlorophenyl)-2-(4-ethyl-1,2,4-triazol-4-ium-1-yl)ethanone iodide Formula: C12H12Cl2IN3O MolecularWeight: 412.05365

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CN(N=C1)CC(=O)C2=C(C=C(C=C2)Cl)Cl.[I-]

Isomeric SMILES

CC[N+]1=CN(N=C1)CC(=O)C2=C(C=C(C=C2)Cl)Cl.[I-]

InChI

InChI=1S/C12H12Cl2N3O.HI/c1-2-16-7-15-17(8-16)6-12(18)10-4-3-9(13)5-11(10)14;/h3-5,7-8H,2,6H2,1H3;1H/q+1;/p-1