4-fluoranyl-N-[[(3S)-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-3-yl]methyl]benzamide

Systemtic Name: 4-fluoranyl-N-[[(3S)-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-3-yl]methyl]benzamide Openeye Name: 4-fluoro-N-[[(3S)-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-3-yl]methyl]benzamide CAS Name: 4-fluoro-N-[[(3S)-1-[(E)-2-methylbut-2-enyl]-3-piperidin-1-iumyl]methyl]benzamide IUPAC Name: 4-fluoro-N-[[(3S)-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-3-yl]methyl]benzamide Traditional Name: 4-fluoro-N-[[(3S)-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-3-yl]methyl]benzamide Formula: C18H26FN2O+ MolecularWeight: 305.410243

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C[NH+]1CCCC(C1)CNC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

C/C=C(\C)/C[NH+]1CCC[C@H](C1)CNC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C18H25FN2O/c1-3-14(2)12-21-10-4-5-15(13-21)11-20-18(22)16-6-8-17(19)9-7-16/h3,6-9,15H,4-5,10-13H2,1-2H3,(H,20,22)/p+1/b14-3+/t15-/m0/s1