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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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