1-(3-ethylbenzimidazol-1-ium-1-yl)-3-(4-propan-2-ylphenoxy)propan-2-ol

Systemtic Name: 1-(3-ethylbenzimidazol-1-ium-1-yl)-3-(4-propan-2-ylphenoxy)propan-2-ol Openeye Name: 1-(3-ethylbenzimidazol-1-ium-1-yl)-3-(4-isopropylphenoxy)propan-2-ol CAS Name: 1-(3-ethyl-1-benzimidazol-1-iumyl)-3-(4-propan-2-ylphenoxy)-2-propanol IUPAC Name: 1-(3-ethylbenzimidazol-1-ium-1-yl)-3-(4-propan-2-ylphenoxy)propan-2-ol Traditional Name: 1-(3-ethylbenzimidazol-1-ium-1-yl)-3-(4-isopropylphenoxy)propan-2-ol Formula: C21H27N2O2+ MolecularWeight: 339.45128

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=[N+](C2=CC=CC=C21)CC(COC3=CC=C(C=C3)C(C)C)O

Isomeric SMILES

CCN1C=[N+](C2=CC=CC=C21)CC(COC3=CC=C(C=C3)C(C)C)O

InChI

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