3-[[(3S)-1-(4-fluorophenyl)sulfonylpiperidin-3-yl]-methyl-amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(3S)-1-(4-fluorophenyl)sulfonylpiperidin-3-yl]-methyl-amino]propyl-dimethyl-azanium Openeye Name: 3-[[(3S)-1-(4-fluorophenyl)sulfonyl-3-piperidyl]-methyl-amino]propyl-dimethyl-ammonium CAS Name: 3-[[(3S)-1-(4-fluorophenyl)sulfonyl-3-piperidinyl]-methylamino]propyl-dimethylammonium IUPAC Name: 3-[[(3S)-1-(4-fluorophenyl)sulfonylpiperidin-3-yl]-methylamino]propyl-dimethylazanium Traditional Name: 3-[[(3S)-1-(4-fluorophenyl)sulfonyl-3-piperidyl]-methyl-amino]propyl-dimethyl-ammonium Formula: C17H29FN3O2S+ MolecularWeight: 358.494463

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN(C)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

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

InChI

InChI=1S/C17H28FN3O2S/c1-19(2)11-5-12-20(3)16-6-4-13-21(14-16)24(22,23)17-9-7-15(18)8-10-17/h7-10,16H,4-6,11-14H2,1-3H3/p+1/t16-/m0/s1