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

Systemtic Name: 3-methyl-2-[(2-methylphenoxy)methyl]-1H-benzimidazol-3-ium Openeye Name: 3-methyl-2-[(2-methylphenoxy)methyl]-1H-benzimidazol-3-ium CAS Name: 3-methyl-2-[(2-methylphenoxy)methyl]-1H-benzimidazol-3-ium IUPAC Name: 3-methyl-2-[(2-methylphenoxy)methyl]-1H-benzimidazol-3-ium Traditional Name: 3-methyl-2-[(2-methylphenoxy)methyl]-1H-benzimidazol-3-ium Formula: C16H17N2O+ MolecularWeight: 253.31898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC2=[N+](C3=CC=CC=C3N2)C

Isomeric SMILES

CC1=CC=CC=C1OCC2=[N+](C3=CC=CC=C3N2)C

InChI

InChI=1S/C16H16N2O/c1-12-7-3-6-10-15(12)19-11-16-17-13-8-4-5-9-14(13)18(16)2/h3-10H,11H2,1-2H3/p+1