N,3,5-trimethyl-N-[2-[(2R)-piperidin-1-ium-2-yl]ethyl]-1H-pyrazole-4-sulfonamide

Systemtic Name: N,3,5-trimethyl-N-[2-[(2R)-piperidin-1-ium-2-yl]ethyl]-1H-pyrazole-4-sulfonamide Openeye Name: N,3,5-trimethyl-N-[2-[(2R)-piperidin-1-ium-2-yl]ethyl]-1H-pyrazole-4-sulfonamide CAS Name: N,3,5-trimethyl-N-[2-[(2R)-2-piperidin-1-iumyl]ethyl]-1H-pyrazole-4-sulfonamide IUPAC Name: N,3,5-trimethyl-N-[2-[(2R)-piperidin-1-ium-2-yl]ethyl]-1H-pyrazole-4-sulfonamide Traditional Name: N,3,5-trimethyl-N-[2-[(2R)-piperidin-1-ium-2-yl]ethyl]-1H-pyrazole-4-sulfonamide Formula: C13H25N4O2S+ MolecularWeight: 301.4282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)S(=O)(=O)N(C)CCC2CCCC[NH2+]2

Isomeric SMILES

CC1=C(C(=NN1)C)S(=O)(=O)N(C)CC[C@H]2CCCC[NH2+]2

InChI

InChI=1S/C13H24N4O2S/c1-10-13(11(2)16-15-10)20(18,19)17(3)9-7-12-6-4-5-8-14-12/h12,14H,4-9H2,1-3H3,(H,15,16)/p+1/t12-/m1/s1