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

Systemtic Name: 4-ethenyl-N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]benzamide Openeye Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-4-vinyl-benzamide CAS Name: 4-ethenyl-N-[(3S)-1-[(2-fluorophenyl)methyl]-3-piperidin-1-iumyl]benzamide IUPAC Name: 4-ethenyl-N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]benzamide Traditional Name: N-[(3S)-1-(2-fluorobenzyl)piperidin-1-ium-3-yl]-4-vinyl-benzamide Formula: C21H24FN2O+ MolecularWeight: 339.426463

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC=C(C=C1)C(=O)NC2CCC[NH+](C2)CC3=CC=CC=C3F

Isomeric SMILES

C=CC1=CC=C(C=C1)C(=O)N[C@H]2CCC[NH+](C2)CC3=CC=CC=C3F

InChI

InChI=1S/C21H23FN2O/c1-2-16-9-11-17(12-10-16)21(25)23-19-7-5-13-24(15-19)14-18-6-3-4-8-20(18)22/h2-4,6,8-12,19H,1,5,7,13-15H2,(H,23,25)/p+1/t19-/m0/s1