1-[2-(3-methylphenoxy)ethyl]-2-(piperidin-1-ium-1-ylmethyl)benzimidazole

Systemtic Name: 1-[2-(3-methylphenoxy)ethyl]-2-(piperidin-1-ium-1-ylmethyl)benzimidazole Openeye Name: 1-[2-(3-methylphenoxy)ethyl]-2-(piperidin-1-ium-1-ylmethyl)benzimidazole CAS Name: 1-[2-(3-methylphenoxy)ethyl]-2-(1-piperidin-1-iumylmethyl)benzimidazole IUPAC Name: 1-[2-(3-methylphenoxy)ethyl]-2-(piperidin-1-ium-1-ylmethyl)benzimidazole Traditional Name: 1-[2-(3-methylphenoxy)ethyl]-2-(piperidin-1-ium-1-ylmethyl)benzimidazole Formula: C22H28N3O+ MolecularWeight: 350.47722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCN2C3=CC=CC=C3N=C2C[NH+]4CCCCC4

Isomeric SMILES

CC1=CC(=CC=C1)OCCN2C3=CC=CC=C3N=C2C[NH+]4CCCCC4

InChI

InChI=1S/C22H27N3O/c1-18-8-7-9-19(16-18)26-15-14-25-21-11-4-3-10-20(21)23-22(25)17-24-12-5-2-6-13-24/h3-4,7-11,16H,2,5-6,12-15,17H2,1H3/p+1