1-[3-[(2,5-dimethylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]ethanol

Systemtic Name: 1-[3-[(2,5-dimethylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]ethanol Openeye Name: 1-[3-[(2,5-dimethylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]ethanol CAS Name: 1-[3-[(2,5-dimethylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]ethanol IUPAC Name: 1-[3-[(2,5-dimethylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]ethanol Traditional Name: 1-[3-(2,5-dimethylbenzyl)-1H-benzimidazol-3-ium-2-yl]ethanol Formula: C18H21N2O+ MolecularWeight: 281.37214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C[N+]2=C(NC3=CC=CC=C32)C(C)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)C[N+]2=C(NC3=CC=CC=C32)C(C)O

InChI

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