2-[4-(5-fluoranylbenzimidazol-1-yl)piperidin-1-ium-1-yl]-N-(3-iodanylphenyl)ethanamide

Systemtic Name: 2-[4-(5-fluoranylbenzimidazol-1-yl)piperidin-1-ium-1-yl]-N-(3-iodanylphenyl)ethanamide Openeye Name: 2-[4-(5-fluorobenzimidazol-1-yl)piperidin-1-ium-1-yl]-N-(3-iodophenyl)acetamide CAS Name: 2-[4-(5-fluoro-1-benzimidazolyl)-1-piperidin-1-iumyl]-N-(3-iodophenyl)acetamide IUPAC Name: 2-[4-(5-fluorobenzimidazol-1-yl)piperidin-1-ium-1-yl]-N-(3-iodophenyl)acetamide Traditional Name: 2-[4-(5-fluorobenzimidazol-1-yl)piperidin-1-ium-1-yl]-N-(3-iodophenyl)acetamide Formula: C20H21FIN4O+ MolecularWeight: 479.309813

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C=NC3=C2C=CC(=C3)F)CC(=O)NC4=CC(=CC=C4)I

Isomeric SMILES

C1C[NH+](CCC1N2C=NC3=C2C=CC(=C3)F)CC(=O)NC4=CC(=CC=C4)I

InChI

InChI=1S/C20H20FIN4O/c21-14-4-5-19-18(10-14)23-13-26(19)17-6-8-25(9-7-17)12-20(27)24-16-3-1-2-15(22)11-16/h1-5,10-11,13,17H,6-9,12H2,(H,24,27)/p+1