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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=CN1CCC(=O)NC2CCC[NH+](C2)CC3=CC=CC=C3F

Isomeric SMILES

CCC1=NC=CN1CCC(=O)N[C@H]2CCC[NH+](C2)CC3=CC=CC=C3F

InChI

InChI=1S/C20H27FN4O/c1-2-19-22-10-13-25(19)12-9-20(26)23-17-7-5-11-24(15-17)14-16-6-3-4-8-18(16)21/h3-4,6,8,10,13,17H,2,5,7,9,11-12,14-15H2,1H3,(H,23,26)/p+1/t17-/m0/s1