2-[(2S)-1-(4-fluoranyl-3-methyl-phenyl)sulfonylpiperidin-2-yl]ethylazanium

Systemtic Name: 2-[(2S)-1-(4-fluoranyl-3-methyl-phenyl)sulfonylpiperidin-2-yl]ethylazanium Openeye Name: 2-[(2S)-1-(4-fluoro-3-methyl-phenyl)sulfonyl-2-piperidyl]ethylammonium CAS Name: 2-[(2S)-1-(4-fluoro-3-methylphenyl)sulfonyl-2-piperidinyl]ethylammonium IUPAC Name: 2-[(2S)-1-(4-fluoro-3-methylphenyl)sulfonylpiperidin-2-yl]ethylazanium Traditional Name: 2-[(2S)-1-(4-fluoro-3-methyl-phenyl)sulfonyl-2-piperidyl]ethylammonium Formula: C14H22FN2O2S+ MolecularWeight: 301.400083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2CC[NH3+])F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCCC[C@H]2CC[NH3+])F

InChI

InChI=1S/C14H21FN2O2S/c1-11-10-13(5-6-14(11)15)20(18,19)17-9-3-2-4-12(17)7-8-16/h5-6,10,12H,2-4,7-9,16H2,1H3/p+1/t12-/m0/s1