1-(1,3-benzodioxol-5-ylmethyl)-5-(chloromethyl)-1H-imidazol-1-ium chloride

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-(chloromethyl)-1H-imidazol-1-ium chloride Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-(chloromethyl)-1H-imidazol-1-ium chloride CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-(chloromethyl)-1H-imidazol-1-ium chloride IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-(chloromethyl)-1H-imidazol-1-ium chloride Traditional Name: 5-(chloromethyl)-1-piperonyl-1H-imidazol-1-ium chloride Formula: C12H12Cl2N2O2 MolecularWeight: 287.14188

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C[NH+]3C=NC=C3CCl.[Cl-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C[NH+]3C=NC=C3CCl.[Cl-]

InChI

InChI=1S/C12H11ClN2O2.ClH/c13-4-10-5-14-7-15(10)6-9-1-2-11-12(3-9)17-8-16-11;/h1-3,5,7H,4,6,8H2;1H