(3S)-N-[(2-fluorophenyl)methyl]piperidin-1-ium-3-sulfonamide

Systemtic Name: (3S)-N-[(2-fluorophenyl)methyl]piperidin-1-ium-3-sulfonamide Openeye Name: (3S)-N-[(2-fluorophenyl)methyl]piperidin-1-ium-3-sulfonamide CAS Name: (3S)-N-[(2-fluorophenyl)methyl]-3-piperidin-1-iumsulfonamide IUPAC Name: (3S)-N-[(2-fluorophenyl)methyl]piperidin-1-ium-3-sulfonamide Traditional Name: (3S)-N-(2-fluorobenzyl)piperidin-1-ium-3-sulfonamide Formula: C12H18FN2O2S+ MolecularWeight: 273.346923

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH2+]C1)S(=O)(=O)NCC2=CC=CC=C2F

Isomeric SMILES

C1C[C@@H](C[NH2+]C1)S(=O)(=O)NCC2=CC=CC=C2F

InChI

InChI=1S/C12H17FN2O2S/c13-12-6-2-1-4-10(12)8-15-18(16,17)11-5-3-7-14-9-11/h1-2,4,6,11,14-15H,3,5,7-9H2/p+1/t11-/m0/s1