(3S)-1-[1-(4-fluorophenyl)piperidin-4-yl]-N-phenyl-piperidin-1-ium-3-amine

Systemtic Name: (3S)-1-[1-(4-fluorophenyl)piperidin-4-yl]-N-phenyl-piperidin-1-ium-3-amine Openeye Name: (3S)-1-[1-(4-fluorophenyl)-4-piperidyl]-N-phenyl-piperidin-1-ium-3-amine CAS Name: (3S)-1-[1-(4-fluorophenyl)-4-piperidinyl]-N-phenyl-3-piperidin-1-iumamine IUPAC Name: (3S)-1-[1-(4-fluorophenyl)piperidin-4-yl]-N-phenylpiperidin-1-ium-3-amine Traditional Name: [(3S)-1-[1-(4-fluorophenyl)-4-piperidyl]piperidin-1-ium-3-yl]-phenyl-amine Formula: C22H29FN3+ MolecularWeight: 354.484163

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)C2CCN(CC2)C3=CC=C(C=C3)F)NC4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](C[NH+](C1)C2CCN(CC2)C3=CC=C(C=C3)F)NC4=CC=CC=C4

InChI

InChI=1S/C22H28FN3/c23-18-8-10-21(11-9-18)25-15-12-22(13-16-25)26-14-4-7-20(17-26)24-19-5-2-1-3-6-19/h1-3,5-6,8-11,20,22,24H,4,7,12-17H2/p+1/t20-/m0/s1