2-fluoranyl-5-methyl-N-[3-[(3S)-3-oxidanylpiperidin-1-ium-1-yl]propyl]benzamide

Systemtic Name: 2-fluoranyl-5-methyl-N-[3-[(3S)-3-oxidanylpiperidin-1-ium-1-yl]propyl]benzamide Openeye Name: 2-fluoro-N-[3-[(3S)-3-hydroxypiperidin-1-ium-1-yl]propyl]-5-methyl-benzamide CAS Name: 2-fluoro-N-[3-[(3S)-3-hydroxy-1-piperidin-1-iumyl]propyl]-5-methylbenzamide IUPAC Name: 2-fluoro-N-[3-[(3S)-3-hydroxypiperidin-1-ium-1-yl]propyl]-5-methylbenzamide Traditional Name: 2-fluoro-N-[3-[(3S)-3-hydroxypiperidin-1-ium-1-yl]propyl]-5-methyl-benzamide Formula: C16H24FN2O2+ MolecularWeight: 295.372363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)F)C(=O)NCCC[NH+]2CCCC(C2)O

Isomeric SMILES

CC1=CC(=C(C=C1)F)C(=O)NCCC[NH+]2CCC[C@@H](C2)O

InChI

InChI=1S/C16H23FN2O2/c1-12-5-6-15(17)14(10-12)16(21)18-7-3-9-19-8-2-4-13(20)11-19/h5-6,10,13,20H,2-4,7-9,11H2,1H3,(H,18,21)/p+1/t13-/m0/s1