3-chloranyl-4-fluoranyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)benzenesulfonamide

Systemtic Name: 3-chloranyl-4-fluoranyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)benzenesulfonamide Openeye Name: 3-chloro-4-fluoro-N-(1-isopropylpiperidin-1-ium-4-yl)benzenesulfonamide CAS Name: 3-chloro-4-fluoro-N-(1-propan-2-yl-4-piperidin-1-iumyl)benzenesulfonamide IUPAC Name: 3-chloro-4-fluoro-N-(1-propan-2-ylpiperidin-1-ium-4-yl)benzenesulfonamide Traditional Name: 3-chloro-4-fluoro-N-(1-isopropylpiperidin-1-ium-4-yl)benzenesulfonamide Formula: C14H21ClFN2O2S+ MolecularWeight: 335.845143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20ClFN2O2S/c1-10(2)18-7-5-11(6-8-18)17-21(19,20)12-3-4-14(16)13(15)9-12/h3-4,9-11,17H,5-8H2,1-2H3/p+1