N-(2,6-dimethylphenyl)-2-[4-(5-fluoranylbenzimidazol-1-yl)piperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-(5-fluoranylbenzimidazol-1-yl)piperidin-1-ium-1-yl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-(5-fluorobenzimidazol-1-yl)piperidin-1-ium-1-yl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[4-(5-fluoro-1-benzimidazolyl)-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-(5-fluorobenzimidazol-1-yl)piperidin-1-ium-1-yl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-(5-fluorobenzimidazol-1-yl)piperidin-1-ium-1-yl]acetamide Formula: C22H26FN4O+ MolecularWeight: 381.466443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CCC(CC2)N3C=NC4=C3C=CC(=C4)F

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CCC(CC2)N3C=NC4=C3C=CC(=C4)F

InChI

InChI=1S/C22H25FN4O/c1-15-4-3-5-16(2)22(15)25-21(28)13-26-10-8-18(9-11-26)27-14-24-19-12-17(23)6-7-20(19)27/h3-7,12,14,18H,8-11,13H2,1-2H3,(H,25,28)/p+1