(3S)-N-(2-ethylphenyl)piperidin-1-ium-3-sulfonamide

Systemtic Name: (3S)-N-(2-ethylphenyl)piperidin-1-ium-3-sulfonamide Openeye Name: (3S)-N-(2-ethylphenyl)piperidin-1-ium-3-sulfonamide CAS Name: (3S)-N-(2-ethylphenyl)-3-piperidin-1-iumsulfonamide IUPAC Name: (3S)-N-(2-ethylphenyl)piperidin-1-ium-3-sulfonamide Traditional Name: (3S)-N-(2-ethylphenyl)piperidin-1-ium-3-sulfonamide Formula: C13H21N2O2S+ MolecularWeight: 269.38304

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NS(=O)(=O)C2CCC[NH2+]C2

Isomeric SMILES

CCC1=CC=CC=C1NS(=O)(=O)[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C13H20N2O2S/c1-2-11-6-3-4-8-13(11)15-18(16,17)12-7-5-9-14-10-12/h3-4,6,8,12,14-15H,2,5,7,9-10H2,1H3/p+1/t12-/m0/s1