1-[3-[(2,3,5,6-tetramethylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]ethanol

Systemtic Name: 1-[3-[(2,3,5,6-tetramethylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]ethanol Openeye Name: 1-[3-[(2,3,5,6-tetramethylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]ethanol CAS Name: 1-[3-[(2,3,5,6-tetramethylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]ethanol IUPAC Name: 1-[3-[(2,3,5,6-tetramethylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]ethanol Traditional Name: 1-[3-(2,3,5,6-tetramethylbenzyl)-1H-benzimidazol-3-ium-2-yl]ethanol Formula: C20H25N2O+ MolecularWeight: 309.4253

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)C[N+]2=C(NC3=CC=CC=C32)C(C)O)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)C[N+]2=C(NC3=CC=CC=C32)C(C)O)C)C

InChI

InChI=1S/C20H24N2O/c1-12-10-13(2)15(4)17(14(12)3)11-22-19-9-7-6-8-18(19)21-20(22)16(5)23/h6-10,16,23H,11H2,1-5H3/p+1