2-[(4-methylphenoxy)methyl]-3-propan-2-yl-1H-benzimidazol-3-ium

Systemtic Name: 2-[(4-methylphenoxy)methyl]-3-propan-2-yl-1H-benzimidazol-3-ium Openeye Name: 3-isopropyl-2-[(4-methylphenoxy)methyl]-1H-benzimidazol-3-ium CAS Name: 2-[(4-methylphenoxy)methyl]-3-propan-2-yl-1H-benzimidazol-3-ium IUPAC Name: 2-[(4-methylphenoxy)methyl]-3-propan-2-yl-1H-benzimidazol-3-ium Traditional Name: 3-isopropyl-2-[(4-methylphenoxy)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)OCC2=[N+](C3=CC=CC=C3N2)C(C)C

Isomeric SMILES

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

InChI

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