1-[2-(3,4-dimethylphenoxy)ethyl]-2-(piperidin-1-ium-1-ylmethyl)benzimidazole

Systemtic Name: 1-[2-(3,4-dimethylphenoxy)ethyl]-2-(piperidin-1-ium-1-ylmethyl)benzimidazole Openeye Name: 1-[2-(3,4-dimethylphenoxy)ethyl]-2-(piperidin-1-ium-1-ylmethyl)benzimidazole CAS Name: 1-[2-(3,4-dimethylphenoxy)ethyl]-2-(1-piperidin-1-iumylmethyl)benzimidazole IUPAC Name: 1-[2-(3,4-dimethylphenoxy)ethyl]-2-(piperidin-1-ium-1-ylmethyl)benzimidazole Traditional Name: 1-[2-(3,4-dimethylphenoxy)ethyl]-2-(piperidin-1-ium-1-ylmethyl)benzimidazole Formula: C23H30N3O+ MolecularWeight: 364.5038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O/c1-18-10-11-20(16-19(18)2)27-15-14-26-22-9-5-4-8-21(22)24-23(26)17-25-12-6-3-7-13-25/h4-5,8-11,16H,3,6-7,12-15,17H2,1-2H3/p+1