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

Systemtic Name: [5,6-dimethyl-1-[4-(3-methylphenoxy)butyl]benzimidazol-2-yl]methylazanium Openeye Name: [5,6-dimethyl-1-[4-(3-methylphenoxy)butyl]benzimidazol-2-yl]methylammonium CAS Name: [5,6-dimethyl-1-[4-(3-methylphenoxy)butyl]-2-benzimidazolyl]methylammonium IUPAC Name: [5,6-dimethyl-1-[4-(3-methylphenoxy)butyl]benzimidazol-2-yl]methylazanium Traditional Name: [5,6-dimethyl-1-[4-(3-methylphenoxy)butyl]benzimidazol-2-yl]methylammonium Formula: C21H28N3O+ MolecularWeight: 338.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCCN2C3=C(C=C(C(=C3)C)C)N=C2C[NH3+]

Isomeric SMILES

CC1=CC(=CC=C1)OCCCCN2C3=C(C=C(C(=C3)C)C)N=C2C[NH3+]

InChI

InChI=1S/C21H27N3O/c1-15-7-6-8-18(11-15)25-10-5-4-9-24-20-13-17(3)16(2)12-19(20)23-21(24)14-22/h6-8,11-13H,4-5,9-10,14,22H2,1-3H3/p+1