3-[(3R)-1-[(1-ethylimidazol-2-yl)methyl]piperidin-1-ium-3-yl]-N-(2-fluorophenyl)propanamide

Systemtic Name: 3-[(3R)-1-[(1-ethylimidazol-2-yl)methyl]piperidin-1-ium-3-yl]-N-(2-fluorophenyl)propanamide Openeye Name: 3-[(3R)-1-[(1-ethylimidazol-2-yl)methyl]piperidin-1-ium-3-yl]-N-(2-fluorophenyl)propanamide CAS Name: 3-[(3R)-1-[(1-ethyl-2-imidazolyl)methyl]-3-piperidin-1-iumyl]-N-(2-fluorophenyl)propanamide IUPAC Name: 3-[(3R)-1-[(1-ethylimidazol-2-yl)methyl]piperidin-1-ium-3-yl]-N-(2-fluorophenyl)propanamide Traditional Name: 3-[(3R)-1-[(1-ethylimidazol-2-yl)methyl]piperidin-1-ium-3-yl]-N-(2-fluorophenyl)propionamide Formula: C20H28FN4O+ MolecularWeight: 359.460923

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CN=C1C[NH+]2CCCC(C2)CCC(=O)NC3=CC=CC=C3F

Isomeric SMILES

CCN1C=CN=C1C[NH+]2CCC[C@@H](C2)CCC(=O)NC3=CC=CC=C3F

InChI

InChI=1S/C20H27FN4O/c1-2-25-13-11-22-19(25)15-24-12-5-6-16(14-24)9-10-20(26)23-18-8-4-3-7-17(18)21/h3-4,7-8,11,13,16H,2,5-6,9-10,12,14-15H2,1H3,(H,23,26)/p+1/t16-/m1/s1