(3S)-1-[(E)-3-(4-fluorophenyl)prop-2-enyl]-N-phenyl-piperidin-1-ium-3-amine

Systemtic Name: (3S)-1-[(E)-3-(4-fluorophenyl)prop-2-enyl]-N-phenyl-piperidin-1-ium-3-amine Openeye Name: (3S)-1-[(E)-3-(4-fluorophenyl)allyl]-N-phenyl-piperidin-1-ium-3-amine CAS Name: (3S)-1-[(E)-3-(4-fluorophenyl)prop-2-enyl]-N-phenyl-3-piperidin-1-iumamine IUPAC Name: (3S)-1-[(E)-3-(4-fluorophenyl)prop-2-enyl]-N-phenylpiperidin-1-ium-3-amine Traditional Name: [(3S)-1-[(E)-3-(4-fluorophenyl)allyl]piperidin-1-ium-3-yl]-phenyl-amine Formula: C20H24FN2+ MolecularWeight: 311.416363

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC=CC2=CC=C(C=C2)F)NC3=CC=CC=C3

Isomeric SMILES

C1C[C@@H](C[NH+](C1)C/C=C/C2=CC=C(C=C2)F)NC3=CC=CC=C3

InChI

InChI=1S/C20H23FN2/c21-18-12-10-17(11-13-18)6-4-14-23-15-5-9-20(16-23)22-19-7-2-1-3-8-19/h1-4,6-8,10-13,20,22H,5,9,14-16H2/p+1/b6-4+/t20-/m0/s1