(2-fluoranyl-5-methyl-phenyl)-[(3S)-piperidin-1-ium-3-yl]sulfonyl-azanide

Systemtic Name: (2-fluoranyl-5-methyl-phenyl)-[(3S)-piperidin-1-ium-3-yl]sulfonyl-azanide Openeye Name: (2-fluoro-5-methyl-phenyl)-[(3S)-piperidin-1-ium-3-yl]sulfonyl-azanide CAS Name: (2-fluoro-5-methylphenyl)-[[(3S)-3-piperidin-1-iumyl]sulfonyl]azanide IUPAC Name: (2-fluoro-5-methylphenyl)-[(3S)-piperidin-1-ium-3-yl]sulfonylazanide Traditional Name: (2-fluoro-5-methyl-phenyl)-[(3S)-piperidin-1-ium-3-yl]sulfonyl-azanide Formula: C12H17FN2O2S MolecularWeight: 272.338983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)F)[N-]S(=O)(=O)C2CCC[NH2+]C2

Isomeric SMILES

CC1=CC(=C(C=C1)F)[N-]S(=O)(=O)[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C12H16FN2O2S/c1-9-4-5-11(13)12(7-9)15-18(16,17)10-3-2-6-14-8-10/h4-5,7,10,14H,2-3,6,8H2,1H3/q-1/p+1/t10-/m0/s1