2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-[(2S)-2-ethyl-1-piperidin-1-iumyl]-1-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-1-[4-(4-fluorophenyl)sulfonylpiperazino]ethanone Formula: C19H29FN3O3S+ MolecularWeight: 398.515263

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC[C@H]1CCCC[NH+]1CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H28FN3O3S/c1-2-17-5-3-4-10-22(17)15-19(24)21-11-13-23(14-12-21)27(25,26)18-8-6-16(20)7-9-18/h6-9,17H,2-5,10-15H2,1H3/p+1/t17-/m0/s1