2-[5,6-dimethyl-1-[4-(3-methylphenoxy)butyl]benzimidazol-2-yl]ethylazanium

Systemtic Name: 2-[5,6-dimethyl-1-[4-(3-methylphenoxy)butyl]benzimidazol-2-yl]ethylazanium Openeye Name: 2-[5,6-dimethyl-1-[4-(3-methylphenoxy)butyl]benzimidazol-2-yl]ethylammonium CAS Name: 2-[5,6-dimethyl-1-[4-(3-methylphenoxy)butyl]-2-benzimidazolyl]ethylammonium IUPAC Name: 2-[5,6-dimethyl-1-[4-(3-methylphenoxy)butyl]benzimidazol-2-yl]ethylazanium Traditional Name: 2-[5,6-dimethyl-1-[4-(3-methylphenoxy)butyl]benzimidazol-2-yl]ethylammonium Formula: C22H30N3O+ MolecularWeight: 352.4931

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCCN2C3=C(C=C(C(=C3)C)C)N=C2CC[NH3+]

Isomeric SMILES

CC1=CC(=CC=C1)OCCCCN2C3=C(C=C(C(=C3)C)C)N=C2CC[NH3+]

InChI

InChI=1S/C22H29N3O/c1-16-7-6-8-19(13-16)26-12-5-4-11-25-21-15-18(3)17(2)14-20(21)24-22(25)9-10-23/h6-8,13-15H,4-5,9-12,23H2,1-3H3/p+1