2-[4-[(2-chloranyl-4-fluoranyl-phenyl)sulfonylamino]piperidin-1-ium-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-[(2-chloranyl-4-fluoranyl-phenyl)sulfonylamino]piperidin-1-ium-1-yl]-N-propan-2-yl-ethanamide Openeye Name: 2-[4-[(2-chloro-4-fluoro-phenyl)sulfonylamino]piperidin-1-ium-1-yl]-N-isopropyl-acetamide CAS Name: 2-[4-[(2-chloro-4-fluorophenyl)sulfonylamino]-1-piperidin-1-iumyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-[(2-chloro-4-fluorophenyl)sulfonylamino]piperidin-1-ium-1-yl]-N-propan-2-ylacetamide Traditional Name: 2-[4-[(2-chloro-4-fluoro-phenyl)sulfonylamino]piperidin-1-ium-1-yl]-N-isopropyl-acetamide Formula: C16H24ClFN3O3S+ MolecularWeight: 392.896463

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C[NH+]1CCC(CC1)NS(=O)(=O)C2=C(C=C(C=C2)F)Cl

Isomeric SMILES

CC(C)NC(=O)C[NH+]1CCC(CC1)NS(=O)(=O)C2=C(C=C(C=C2)F)Cl

InChI

InChI=1S/C16H23ClFN3O3S/c1-11(2)19-16(22)10-21-7-5-13(6-8-21)20-25(23,24)15-4-3-12(18)9-14(15)17/h3-4,9,11,13,20H,5-8,10H2,1-2H3,(H,19,22)/p+1