1-methyl-3-prop-2-enyl-benzimidazol-1-ium iodide

Systemtic Name: 1-methyl-3-prop-2-enyl-benzimidazol-1-ium iodide Openeye Name: 1-allyl-3-methyl-benzimidazol-3-ium iodide CAS Name: 1-methyl-3-prop-2-enylbenzimidazol-1-ium iodide IUPAC Name: 1-methyl-3-prop-2-enylbenzimidazol-1-ium iodide Traditional Name: 1-allyl-3-methyl-benzimidazol-3-ium iodide Formula: C11H13IN2 MolecularWeight: 300.13879

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C2=CC=CC=C21)CC=C.[I-]

Isomeric SMILES

C[N+]1=CN(C2=CC=CC=C21)CC=C.[I-]

InChI

InChI=1S/C11H13N2.HI/c1-3-8-13-9-12(2)10-6-4-5-7-11(10)13;/h3-7,9H,1,8H2,2H3;1H/q+1;/p-1