4-ethanoyl-N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]benzamide

Systemtic Name: 4-ethanoyl-N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]benzamide Openeye Name: 4-acetyl-N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]benzamide CAS Name: 4-acetyl-N-[(3S)-1-[(2-fluorophenyl)methyl]-3-piperidin-1-iumyl]benzamide IUPAC Name: 4-acetyl-N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]benzamide Traditional Name: 4-acetyl-N-[(3S)-1-(2-fluorobenzyl)piperidin-1-ium-3-yl]benzamide Formula: C21H24FN2O2+ MolecularWeight: 355.425863

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C(=O)NC2CCC[NH+](C2)CC3=CC=CC=C3F

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C(=O)N[C@H]2CCC[NH+](C2)CC3=CC=CC=C3F

InChI

InChI=1S/C21H23FN2O2/c1-15(25)16-8-10-17(11-9-16)21(26)23-19-6-4-12-24(14-19)13-18-5-2-3-7-20(18)22/h2-3,5,7-11,19H,4,6,12-14H2,1H3,(H,23,26)/p+1/t19-/m0/s1