1-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-3-ethenyl-benzimidazol-1-ium

Systemtic Name: 1-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-3-ethenyl-benzimidazol-1-ium Openeye Name: 1-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-3-vinyl-benzimidazol-1-ium CAS Name: 1-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-3-ethenylbenzimidazol-1-ium IUPAC Name: 1-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-3-ethenylbenzimidazol-1-ium Traditional Name: 1-(4-tert-butyl-2,6-dimethyl-benzyl)-3-vinyl-benzimidazol-1-ium Formula: C22H27N2+ MolecularWeight: 319.46318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C[N+]2=CN(C3=CC=CC=C32)C=C)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1C[N+]2=CN(C3=CC=CC=C32)C=C)C)C(C)(C)C

InChI

InChI=1S/C22H27N2/c1-7-23-15-24(21-11-9-8-10-20(21)23)14-19-16(2)12-18(13-17(19)3)22(4,5)6/h7-13,15H,1,14H2,2-6H3/q+1