[(3S)-1-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperidin-3-yl]-methyl-(2-pyridin-2-ylethyl)azanium

Systemtic Name: [(3S)-1-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperidin-3-yl]-methyl-(2-pyridin-2-ylethyl)azanium Openeye Name: [(3S)-1-(3-chloro-4-fluoro-phenyl)sulfonyl-3-piperidyl]-methyl-[2-(2-pyridyl)ethyl]ammonium CAS Name: [(3S)-1-(3-chloro-4-fluorophenyl)sulfonyl-3-piperidinyl]-methyl-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: [(3S)-1-(3-chloro-4-fluorophenyl)sulfonylpiperidin-3-yl]-methyl-(2-pyridin-2-ylethyl)azanium Traditional Name: [(3S)-1-(3-chloro-4-fluoro-phenyl)sulfonyl-3-piperidyl]-methyl-[2-(2-pyridyl)ethyl]ammonium Formula: C19H24ClFN3O2S+ MolecularWeight: 412.929163

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=N1)C2CCCN(C2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C[NH+](CCC1=CC=CC=N1)[C@H]2CCCN(C2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C19H23ClFN3O2S/c1-23(12-9-15-5-2-3-10-22-15)16-6-4-11-24(14-16)27(25,26)17-7-8-19(21)18(20)13-17/h2-3,5,7-8,10,13,16H,4,6,9,11-12,14H2,1H3/p+1/t16-/m0/s1