1-(4-bromophenyl)-2-(2-methyl-3-prop-2-enyl-benzimidazol-1-ium-1-yl)ethanone

Systemtic Name: 1-(4-bromophenyl)-2-(2-methyl-3-prop-2-enyl-benzimidazol-1-ium-1-yl)ethanone Openeye Name: 2-(3-allyl-2-methyl-benzimidazol-1-ium-1-yl)-1-(4-bromophenyl)ethanone CAS Name: 1-(4-bromophenyl)-2-(2-methyl-3-prop-2-enyl-1-benzimidazol-1-iumyl)ethanone IUPAC Name: 1-(4-bromophenyl)-2-(2-methyl-3-prop-2-enylbenzimidazol-1-ium-1-yl)ethanone Traditional Name: 2-(3-allyl-2-methyl-benzimidazol-1-ium-1-yl)-1-(4-bromophenyl)ethanone Formula: C19H18BrN2O+ MolecularWeight: 370.26302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18BrN2O/c1-3-12-21-14(2)22(18-7-5-4-6-17(18)21)13-19(23)15-8-10-16(20)11-9-15/h3-11H,1,12-13H2,2H3/q+1