2-(3-ethenylbenzimidazol-1-ium-1-yl)-1-[1-[(2R)-1-methoxypropan-2-yl]-2,5-dimethyl-pyrrol-3-yl]ethanone

Systemtic Name: 2-(3-ethenylbenzimidazol-1-ium-1-yl)-1-[1-[(2R)-1-methoxypropan-2-yl]-2,5-dimethyl-pyrrol-3-yl]ethanone Openeye Name: 1-[1-[(1R)-2-methoxy-1-methyl-ethyl]-2,5-dimethyl-pyrrol-3-yl]-2-(3-vinylbenzimidazol-1-ium-1-yl)ethanone CAS Name: 2-(3-ethenyl-1-benzimidazol-1-iumyl)-1-[1-[(2R)-1-methoxypropan-2-yl]-2,5-dimethyl-3-pyrrolyl]ethanone IUPAC Name: 2-(3-ethenylbenzimidazol-1-ium-1-yl)-1-[1-[(2R)-1-methoxypropan-2-yl]-2,5-dimethylpyrrol-3-yl]ethanone Traditional Name: 1-[1-[(1R)-2-methoxy-1-methyl-ethyl]-2,5-dimethyl-pyrrol-3-yl]-2-(3-vinylbenzimidazol-1-ium-1-yl)ethanone Formula: C21H26N3O2+ MolecularWeight: 352.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)COC)C)C(=O)C[N+]2=CN(C3=CC=CC=C32)C=C

Isomeric SMILES

CC1=CC(=C(N1[C@H](C)COC)C)C(=O)C[N+]2=CN(C3=CC=CC=C32)C=C

InChI

InChI=1S/C21H26N3O2/c1-6-22-14-23(20-10-8-7-9-19(20)22)12-21(25)18-11-15(2)24(17(18)4)16(3)13-26-5/h6-11,14,16H,1,12-13H2,2-5H3/q+1/t16-/m1/s1