1-(3-methylphenoxy)-3-(3-methyl-2-propyl-benzimidazol-3-ium-1-yl)propan-2-ol

Systemtic Name: 1-(3-methylphenoxy)-3-(3-methyl-2-propyl-benzimidazol-3-ium-1-yl)propan-2-ol Openeye Name: 1-(3-methylphenoxy)-3-(3-methyl-2-propyl-benzimidazol-3-ium-1-yl)propan-2-ol CAS Name: 1-(3-methylphenoxy)-3-(3-methyl-2-propyl-1-benzimidazol-3-iumyl)-2-propanol IUPAC Name: 1-(3-methylphenoxy)-3-(3-methyl-2-propylbenzimidazol-3-ium-1-yl)propan-2-ol Traditional Name: 1-(3-methylphenoxy)-3-(3-methyl-2-propyl-benzimidazol-3-ium-1-yl)propan-2-ol Formula: C21H27N2O2+ MolecularWeight: 339.45128

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=[N+](C2=CC=CC=C2N1CC(COC3=CC=CC(=C3)C)O)C

Isomeric SMILES

CCCC1=[N+](C2=CC=CC=C2N1CC(COC3=CC=CC(=C3)C)O)C

InChI

InChI=1S/C21H27N2O2/c1-4-8-21-22(3)19-11-5-6-12-20(19)23(21)14-17(24)15-25-18-10-7-9-16(2)13-18/h5-7,9-13,17,24H,4,8,14-15H2,1-3H3/q+1