2-[5,6-dimethyl-1-(4-phenoxybutyl)benzimidazol-2-yl]ethyl-methyl-azanium

Systemtic Name: 2-[5,6-dimethyl-1-(4-phenoxybutyl)benzimidazol-2-yl]ethyl-methyl-azanium Openeye Name: 2-[5,6-dimethyl-1-(4-phenoxybutyl)benzimidazol-2-yl]ethyl-methyl-ammonium CAS Name: 2-[5,6-dimethyl-1-(4-phenoxybutyl)-2-benzimidazolyl]ethyl-methylammonium IUPAC Name: 2-[5,6-dimethyl-1-(4-phenoxybutyl)benzimidazol-2-yl]ethyl-methylazanium Traditional Name: 2-[5,6-dimethyl-1-(4-phenoxybutyl)benzimidazol-2-yl]ethyl-methyl-ammonium Formula: C22H30N3O+ MolecularWeight: 352.4931

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)CC[NH2+]C)CCCCOC3=CC=CC=C3

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)CC[NH2+]C)CCCCOC3=CC=CC=C3

InChI

InChI=1S/C22H29N3O/c1-17-15-20-21(16-18(17)2)25(22(24-20)11-12-23-3)13-7-8-14-26-19-9-5-4-6-10-19/h4-6,9-10,15-16,23H,7-8,11-14H2,1-3H3/p+1