2-(phenoxymethyl)-3-propan-2-yl-1H-benzimidazol-3-ium

Systemtic Name: 2-(phenoxymethyl)-3-propan-2-yl-1H-benzimidazol-3-ium Openeye Name: 3-isopropyl-2-(phenoxymethyl)-1H-benzimidazol-3-ium CAS Name: 2-(phenoxymethyl)-3-propan-2-yl-1H-benzimidazol-3-ium IUPAC Name: 2-(phenoxymethyl)-3-propan-2-yl-1H-benzimidazol-3-ium Traditional Name: 3-isopropyl-2-(phenoxymethyl)-1H-benzimidazol-3-ium Formula: C17H19N2O+ MolecularWeight: 267.34556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1=C(NC2=CC=CC=C21)COC3=CC=CC=C3

Isomeric SMILES

CC(C)[N+]1=C(NC2=CC=CC=C21)COC3=CC=CC=C3

InChI

InChI=1S/C17H18N2O/c1-13(2)19-16-11-7-6-10-15(16)18-17(19)12-20-14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3/p+1