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

Systemtic Name: 3-chloranyl-4-fluoranyl-N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]benzenesulfonamide Openeye Name: 3-chloro-4-fluoro-N-[(1-isopropylpiperidin-1-ium-4-yl)methyl]benzenesulfonamide CAS Name: 3-chloro-4-fluoro-N-[(1-propan-2-yl-4-piperidin-1-iumyl)methyl]benzenesulfonamide IUPAC Name: 3-chloro-4-fluoro-N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]benzenesulfonamide Traditional Name: 3-chloro-4-fluoro-N-[(1-isopropylpiperidin-1-ium-4-yl)methyl]benzenesulfonamide Formula: C15H23ClFN2O2S+ MolecularWeight: 349.871723

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22ClFN2O2S/c1-11(2)19-7-5-12(6-8-19)10-18-22(20,21)13-3-4-15(17)14(16)9-13/h3-4,9,11-12,18H,5-8,10H2,1-2H3/p+1