2-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-1H-benzimidazol-3-ium

Systemtic Name: 2-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-1H-benzimidazol-3-ium Openeye Name: 2-[(2-isopropyl-5-methyl-phenoxy)methyl]-1H-benzimidazol-3-ium CAS Name: 2-[(5-methyl-2-propan-2-ylphenoxy)methyl]-1H-benzimidazol-3-ium IUPAC Name: 2-[(5-methyl-2-propan-2-ylphenoxy)methyl]-1H-benzimidazol-3-ium Traditional Name: 2-[(2-isopropyl-5-methyl-phenoxy)methyl]-1H-benzimidazol-3-ium Formula: C18H21N2O+ MolecularWeight: 281.37214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC2=[NH+]C3=CC=CC=C3N2

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC2=[NH+]C3=CC=CC=C3N2

InChI

InChI=1S/C18H20N2O/c1-12(2)14-9-8-13(3)10-17(14)21-11-18-19-15-6-4-5-7-16(15)20-18/h4-10,12H,11H2,1-3H3,(H,19,20)/p+1