2-chloranyl-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)sulfamoyl]benzoate

Systemtic Name: 2-chloranyl-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)sulfamoyl]benzoate Openeye Name: 2-chloro-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)sulfamoyl]benzoate CAS Name: 2-chloro-5-[(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)sulfamoyl]benzoate IUPAC Name: 2-chloro-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)sulfamoyl]benzoate Traditional Name: 2-chloro-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)sulfamoyl]benzoate Formula: C16H23ClN2O4S MolecularWeight: 374.88282

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)NS(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)[O-])C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)NS(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)[O-])C

InChI

InChI=1S/C16H23ClN2O4S/c1-15(2)8-10(9-16(3,4)19-15)18-24(22,23)11-5-6-13(17)12(7-11)14(20)21/h5-7,10,18-19H,8-9H2,1-4H3,(H,20,21)