4-butyl-1-ethenyl-1,2,4-triazol-4-ium iodide

Systemtic Name: 4-butyl-1-ethenyl-1,2,4-triazol-4-ium iodide Openeye Name: 4-butyl-1-vinyl-1,2,4-triazol-4-ium iodide CAS Name: 4-butyl-1-ethenyl-1,2,4-triazol-4-ium iodide IUPAC Name: 4-butyl-1-ethenyl-1,2,4-triazol-4-ium iodide Traditional Name: 4-butyl-1-vinyl-1,2,4-triazol-4-ium iodide Formula: C8H14IN3 MolecularWeight: 279.12133

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=CN(N=C1)C=C.[I-]

Isomeric SMILES

CCCC[N+]1=CN(N=C1)C=C.[I-]

InChI

InChI=1S/C8H14N3.HI/c1-3-5-6-10-7-9-11(4-2)8-10;/h4,7-8H,2-3,5-6H2,1H3;1H/q+1;/p-1