1-(2-ethyl-3-methyl-benzimidazol-3-ium-1-yl)-3-(2-methyl-5-propan-2-yl-phenoxy)propan-2-ol

Systemtic Name: 1-(2-ethyl-3-methyl-benzimidazol-3-ium-1-yl)-3-(2-methyl-5-propan-2-yl-phenoxy)propan-2-ol Openeye Name: 1-(2-ethyl-3-methyl-benzimidazol-3-ium-1-yl)-3-(5-isopropyl-2-methyl-phenoxy)propan-2-ol CAS Name: 1-(2-ethyl-3-methyl-1-benzimidazol-3-iumyl)-3-(2-methyl-5-propan-2-ylphenoxy)-2-propanol IUPAC Name: 1-(2-ethyl-3-methylbenzimidazol-3-ium-1-yl)-3-(2-methyl-5-propan-2-ylphenoxy)propan-2-ol Traditional Name: 1-(2-ethyl-3-methyl-benzimidazol-3-ium-1-yl)-3-(5-isopropyl-2-methyl-phenoxy)propan-2-ol Formula: C23H31N2O2+ MolecularWeight: 367.50444

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=[N+](C2=CC=CC=C2N1CC(COC3=C(C=CC(=C3)C(C)C)C)O)C

Isomeric SMILES

CCC1=[N+](C2=CC=CC=C2N1CC(COC3=C(C=CC(=C3)C(C)C)C)O)C

InChI

InChI=1S/C23H31N2O2/c1-6-23-24(5)20-9-7-8-10-21(20)25(23)14-19(26)15-27-22-13-18(16(2)3)12-11-17(22)4/h7-13,16,19,26H,6,14-15H2,1-5H3/q+1