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

Systemtic Name: 1-(4-tert-butylphenyl)-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-tert-butylphenyl)ethanone CAS Name: 1-(4-tert-butylphenyl)-2-(2-methyl-3-prop-2-enyl-1-benzimidazol-1-iumyl)ethanone IUPAC Name: 1-(4-tert-butylphenyl)-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-tert-butylphenyl)ethanone Formula: C23H27N2O+ MolecularWeight: 347.47328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N2O/c1-6-15-24-17(2)25(21-10-8-7-9-20(21)24)16-22(26)18-11-13-19(14-12-18)23(3,4)5/h6-14H,1,15-16H2,2-5H3/q+1