3-fluoranyl-4-methyl-N-[(3S)-piperidin-1-ium-3-yl]benzamide

Systemtic Name: 3-fluoranyl-4-methyl-N-[(3S)-piperidin-1-ium-3-yl]benzamide Openeye Name: 3-fluoro-4-methyl-N-[(3S)-piperidin-1-ium-3-yl]benzamide CAS Name: 3-fluoro-4-methyl-N-[(3S)-3-piperidin-1-iumyl]benzamide IUPAC Name: 3-fluoro-4-methyl-N-[(3S)-piperidin-1-ium-3-yl]benzamide Traditional Name: 3-fluoro-4-methyl-N-[(3S)-piperidin-1-ium-3-yl]benzamide Formula: C13H18FN2O+ MolecularWeight: 237.293223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CCC[NH2+]C2)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N[C@H]2CCC[NH2+]C2)F

InChI

InChI=1S/C13H17FN2O/c1-9-4-5-10(7-12(9)14)13(17)16-11-3-2-6-15-8-11/h4-5,7,11,15H,2-3,6,8H2,1H3,(H,16,17)/p+1/t11-/m0/s1