(2S)-1-(4-tert-butylphenoxy)-3-(2-methyl-1H-imidazol-3-ium-3-yl)propan-2-ol

Systemtic Name: (2S)-1-(4-tert-butylphenoxy)-3-(2-methyl-1H-imidazol-3-ium-3-yl)propan-2-ol Openeye Name: (2S)-1-(4-tert-butylphenoxy)-3-(2-methyl-1H-imidazol-3-ium-3-yl)propan-2-ol CAS Name: (2S)-1-(4-tert-butylphenoxy)-3-(2-methyl-1H-imidazol-3-ium-3-yl)-2-propanol IUPAC Name: (2S)-1-(4-tert-butylphenoxy)-3-(2-methyl-1H-imidazol-3-ium-3-yl)propan-2-ol Traditional Name: (2S)-1-(4-tert-butylphenoxy)-3-(2-methyl-1H-imidazol-3-ium-3-yl)propan-2-ol Formula: C17H25N2O2+ MolecularWeight: 289.3926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CN1)CC(COC2=CC=C(C=C2)C(C)(C)C)O

Isomeric SMILES

CC1=[N+](C=CN1)C[C@@H](COC2=CC=C(C=C2)C(C)(C)C)O

InChI

InChI=1S/C17H24N2O2/c1-13-18-9-10-19(13)11-15(20)12-21-16-7-5-14(6-8-16)17(2,3)4/h5-10,15,20H,11-12H2,1-4H3/p+1/t15-/m0/s1