N-[3-[(2S)-2-ethylpiperidin-1-ium-1-yl]propyl]-1-(4-fluorophenyl)methanesulfonamide

Systemtic Name: N-[3-[(2S)-2-ethylpiperidin-1-ium-1-yl]propyl]-1-(4-fluorophenyl)methanesulfonamide Openeye Name: N-[3-[(2S)-2-ethylpiperidin-1-ium-1-yl]propyl]-1-(4-fluorophenyl)methanesulfonamide CAS Name: N-[3-[(2S)-2-ethyl-1-piperidin-1-iumyl]propyl]-1-(4-fluorophenyl)methanesulfonamide IUPAC Name: N-[3-[(2S)-2-ethylpiperidin-1-ium-1-yl]propyl]-1-(4-fluorophenyl)methanesulfonamide Traditional Name: N-[3-[(2S)-2-ethylpiperidin-1-ium-1-yl]propyl]-1-(4-fluorophenyl)methanesulfonamide Formula: C17H28FN2O2S+ MolecularWeight: 343.479823

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CCCNS(=O)(=O)CC2=CC=C(C=C2)F

Isomeric SMILES

CC[C@H]1CCCC[NH+]1CCCNS(=O)(=O)CC2=CC=C(C=C2)F

InChI

InChI=1S/C17H27FN2O2S/c1-2-17-6-3-4-12-20(17)13-5-11-19-23(21,22)14-15-7-9-16(18)10-8-15/h7-10,17,19H,2-6,11-14H2,1H3/p+1/t17-/m0/s1