2-(2-methyl-3-prop-2-enyl-benzimidazol-1-ium-1-yl)-1-phenyl-ethanone bromide

Systemtic Name: 2-(2-methyl-3-prop-2-enyl-benzimidazol-1-ium-1-yl)-1-phenyl-ethanone bromide Openeye Name: 2-(3-allyl-2-methyl-benzimidazol-1-ium-1-yl)-1-phenyl-ethanone bromide CAS Name: 2-(2-methyl-3-prop-2-enyl-1-benzimidazol-1-iumyl)-1-phenylethanone bromide IUPAC Name: 2-(2-methyl-3-prop-2-enylbenzimidazol-1-ium-1-yl)-1-phenylethanone bromide Traditional Name: 2-(3-allyl-2-methyl-benzimidazol-1-ium-1-yl)-1-phenyl-ethanone bromide Formula: C19H19BrN2O MolecularWeight: 371.27096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=CC=CC=C2N1CC=C)CC(=O)C3=CC=CC=C3.[Br-]

Isomeric SMILES

CC1=[N+](C2=CC=CC=C2N1CC=C)CC(=O)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C19H19N2O.BrH/c1-3-13-20-15(2)21(18-12-8-7-11-17(18)20)14-19(22)16-9-5-4-6-10-16;/h3-12H,1,13-14H2,2H3;1H/q+1;/p-1