1-(2-chloranylphenoxy)-3-(3-methyl-2-propan-2-yl-benzimidazol-3-ium-1-yl)propan-2-ol iodide

Systemtic Name: 1-(2-chloranylphenoxy)-3-(3-methyl-2-propan-2-yl-benzimidazol-3-ium-1-yl)propan-2-ol iodide Openeye Name: 1-(2-chlorophenoxy)-3-(2-isopropyl-3-methyl-benzimidazol-3-ium-1-yl)propan-2-ol iodide CAS Name: 1-(2-chlorophenoxy)-3-(3-methyl-2-propan-2-yl-1-benzimidazol-3-iumyl)-2-propanol iodide IUPAC Name: 1-(2-chlorophenoxy)-3-(3-methyl-2-propan-2-ylbenzimidazol-3-ium-1-yl)propan-2-ol iodide Traditional Name: 1-(2-chlorophenoxy)-3-(2-isopropyl-3-methyl-benzimidazol-3-ium-1-yl)propan-2-ol iodide Formula: C20H24ClIN2O2 MolecularWeight: 486.77423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=[N+](C2=CC=CC=C2N1CC(COC3=CC=CC=C3Cl)O)C.[I-]

Isomeric SMILES

CC(C)C1=[N+](C2=CC=CC=C2N1CC(COC3=CC=CC=C3Cl)O)C.[I-]

InChI

InChI=1S/C20H24ClN2O2.HI/c1-14(2)20-22(3)17-9-5-6-10-18(17)23(20)12-15(24)13-25-19-11-7-4-8-16(19)21;/h4-11,14-15,24H,12-13H2,1-3H3;1H/q+1;/p-1