1-(cyclohex-3-en-1-ylmethoxy)-3-(3-ethyl-2-methyl-benzimidazol-1-ium-1-yl)propan-2-ol iodide

Systemtic Name: 1-(cyclohex-3-en-1-ylmethoxy)-3-(3-ethyl-2-methyl-benzimidazol-1-ium-1-yl)propan-2-ol iodide Openeye Name: 1-(cyclohex-3-en-1-ylmethoxy)-3-(3-ethyl-2-methyl-benzimidazol-1-ium-1-yl)propan-2-ol iodide CAS Name: 1-(1-cyclohex-3-enylmethoxy)-3-(3-ethyl-2-methyl-1-benzimidazol-1-iumyl)-2-propanol iodide IUPAC Name: 1-(cyclohex-3-en-1-ylmethoxy)-3-(3-ethyl-2-methylbenzimidazol-1-ium-1-yl)propan-2-ol iodide Traditional Name: 1-(cyclohex-3-en-1-ylmethoxy)-3-(3-ethyl-2-methyl-benzimidazol-1-ium-1-yl)propan-2-ol iodide Formula: C20H29IN2O2 MolecularWeight: 456.36093

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=[N+](C2=CC=CC=C21)CC(COCC3CCC=CC3)O)C.[I-]

Isomeric SMILES

CCN1C(=[N+](C2=CC=CC=C21)CC(COCC3CCC=CC3)O)C.[I-]

InChI

InChI=1S/C20H29N2O2.HI/c1-3-21-16(2)22(20-12-8-7-11-19(20)21)13-18(23)15-24-14-17-9-5-4-6-10-17;/h4-5,7-8,11-12,17-18,23H,3,6,9-10,13-15H2,1-2H3;1H/q+1;/p-1