[4-fluoranyl-3-[(3S)-3-methylpiperidin-1-yl]sulfonyl-phenyl]methylazanium

Systemtic Name: [4-fluoranyl-3-[(3S)-3-methylpiperidin-1-yl]sulfonyl-phenyl]methylazanium Openeye Name: [4-fluoro-3-[[(3S)-3-methyl-1-piperidyl]sulfonyl]phenyl]methylammonium CAS Name: [4-fluoro-3-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]phenyl]methylammonium IUPAC Name: [4-fluoro-3-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]methylazanium Traditional Name: [4-fluoro-3-[(3S)-3-methylpiperidino]sulfonyl-benzyl]ammonium Formula: C13H20FN2O2S+ MolecularWeight: 287.373503

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C[NH3+])F

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C[NH3+])F

InChI

InChI=1S/C13H19FN2O2S/c1-10-3-2-6-16(9-10)19(17,18)13-7-11(8-15)4-5-12(13)14/h4-5,7,10H,2-3,6,8-9,15H2,1H3/p+1/t10-/m0/s1