1-[4-[3-(2,3-dimethylbenzimidazol-3-ium-1-yl)-2-oxidanyl-propoxy]phenyl]ethanone

Systemtic Name: 1-[4-[3-(2,3-dimethylbenzimidazol-3-ium-1-yl)-2-oxidanyl-propoxy]phenyl]ethanone Openeye Name: 1-[4-[3-(2,3-dimethylbenzimidazol-3-ium-1-yl)-2-hydroxy-propoxy]phenyl]ethanone CAS Name: 1-[4-[3-(2,3-dimethyl-1-benzimidazol-3-iumyl)-2-hydroxypropoxy]phenyl]ethanone IUPAC Name: 1-[4-[3-(2,3-dimethylbenzimidazol-3-ium-1-yl)-2-hydroxypropoxy]phenyl]ethanone Traditional Name: 1-[4-[3-(2,3-dimethylbenzimidazol-3-ium-1-yl)-2-hydroxy-propoxy]phenyl]ethanone Formula: C20H23N2O3+ MolecularWeight: 339.40822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=CC=CC=C2N1CC(COC3=CC=C(C=C3)C(=O)C)O)C

Isomeric SMILES

CC1=[N+](C2=CC=CC=C2N1CC(COC3=CC=C(C=C3)C(=O)C)O)C

InChI

InChI=1S/C20H23N2O3/c1-14(23)16-8-10-18(11-9-16)25-13-17(24)12-22-15(2)21(3)19-6-4-5-7-20(19)22/h4-11,17,24H,12-13H2,1-3H3/q+1