2-(3,4-dimethoxyphenyl)ethyl-[(5,6-dimethylbenzimidazol-1-yl)methyl]-methyl-azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-[(5,6-dimethylbenzimidazol-1-yl)methyl]-methyl-azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-[(5,6-dimethylbenzimidazol-1-yl)methyl]-methyl-ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-[(5,6-dimethyl-1-benzimidazolyl)methyl]-methylammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-[(5,6-dimethylbenzimidazol-1-yl)methyl]-methylazanium Traditional Name: (5,6-dimethylbenzimidazol-1-yl)methyl-homoveratryl-methyl-ammonium Formula: C21H28N3O2+ MolecularWeight: 354.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C=N2)C[NH+](C)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C=N2)C[NH+](C)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H27N3O2/c1-15-10-18-19(11-16(15)2)24(13-22-18)14-23(3)9-8-17-6-7-20(25-4)21(12-17)26-5/h6-7,10-13H,8-9,14H2,1-5H3/p+1