2-[(4-methoxyphenoxy)methyl]-3-(3-methylbutyl)-1H-benzimidazol-3-ium

Systemtic Name: 2-[(4-methoxyphenoxy)methyl]-3-(3-methylbutyl)-1H-benzimidazol-3-ium Openeye Name: 3-isopentyl-2-[(4-methoxyphenoxy)methyl]-1H-benzimidazol-3-ium CAS Name: 2-[(4-methoxyphenoxy)methyl]-3-(3-methylbutyl)-1H-benzimidazol-3-ium IUPAC Name: 2-[(4-methoxyphenoxy)methyl]-3-(3-methylbutyl)-1H-benzimidazol-3-ium Traditional Name: 3-isoamyl-2-[(4-methoxyphenoxy)methyl]-1H-benzimidazol-3-ium Formula: C20H25N2O2+ MolecularWeight: 325.4247

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC[N+]1=C(NC2=CC=CC=C21)COC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)CC[N+]1=C(NC2=CC=CC=C21)COC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H24N2O2/c1-15(2)12-13-22-19-7-5-4-6-18(19)21-20(22)14-24-17-10-8-16(23-3)9-11-17/h4-11,15H,12-14H2,1-3H3/p+1