1-(phenylmethyl)-3-prop-2-enyl-benzimidazol-1-ium bromide

Systemtic Name: 1-(phenylmethyl)-3-prop-2-enyl-benzimidazol-1-ium bromide Openeye Name: 1-allyl-3-benzyl-benzimidazol-3-ium bromide CAS Name: 1-(phenylmethyl)-3-prop-2-enylbenzimidazol-1-ium bromide IUPAC Name: 1-benzyl-3-prop-2-enylbenzimidazol-1-ium bromide Traditional Name: 1-allyl-3-benzyl-benzimidazol-3-ium bromide Formula: C17H17BrN2 MolecularWeight: 329.23428

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C=[N+](C2=CC=CC=C21)CC3=CC=CC=C3.[Br-]

Isomeric SMILES

C=CCN1C=[N+](C2=CC=CC=C21)CC3=CC=CC=C3.[Br-]

InChI

InChI=1S/C17H17N2.BrH/c1-2-12-18-14-19(13-15-8-4-3-5-9-15)17-11-7-6-10-16(17)18;/h2-11,14H,1,12-13H2;1H/q+1;/p-1