4-chloranyl-3-[(4-fluorophenyl)sulfonylamino]-N-(2-methyl-2-piperidin-1-ium-1-yl-propyl)benzenecarboximidate

Systemtic Name: 4-chloranyl-3-[(4-fluorophenyl)sulfonylamino]-N-(2-methyl-2-piperidin-1-ium-1-yl-propyl)benzenecarboximidate Openeye Name: 4-chloro-3-[(4-fluorophenyl)sulfonylamino]-N-(2-methyl-2-piperidin-1-ium-1-yl-propyl)benzenecarboximidate CAS Name: 4-chloro-3-[(4-fluorophenyl)sulfonylamino]-N-[2-methyl-2-(1-piperidin-1-iumyl)propyl]benzenecarboximidate IUPAC Name: 4-chloro-3-[(4-fluorophenyl)sulfonylamino]-N-(2-methyl-2-piperidin-1-ium-1-ylpropyl)benzenecarboximidate Traditional Name: 4-chloro-3-[(4-fluorophenyl)sulfonylamino]-N-(2-methyl-2-piperidin-1-ium-1-yl-propyl)benzenecarboximidate Formula: C22H27ClFN3O3S MolecularWeight: 467.984483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN=C(C1=CC(=C(C=C1)Cl)NS(=O)(=O)C2=CC=C(C=C2)F)[O-])[NH+]3CCCCC3

Isomeric SMILES

CC(C)(CN=C(C1=CC(=C(C=C1)Cl)NS(=O)(=O)C2=CC=C(C=C2)F)[O-])[NH+]3CCCCC3

InChI

InChI=1S/C22H27ClFN3O3S/c1-22(2,27-12-4-3-5-13-27)15-25-21(28)16-6-11-19(23)20(14-16)26-31(29,30)18-9-7-17(24)8-10-18/h6-11,14,26H,3-5,12-13,15H2,1-2H3,(H,25,28)