4-chloranyl-3-[[2-(dimethylaminomethyl)phenyl]methylsulfamoyl]benzoic acid

Systemtic Name: 4-chloranyl-3-[[2-(dimethylaminomethyl)phenyl]methylsulfamoyl]benzoic acid Openeye Name: 4-chloro-3-[[2-(dimethylaminomethyl)phenyl]methylsulfamoyl]benzoic acid CAS Name: 4-chloro-3-[[2-(dimethylaminomethyl)phenyl]methylsulfamoyl]benzoic acid IUPAC Name: 4-chloro-3-[[2-(dimethylaminomethyl)phenyl]methylsulfamoyl]benzoic acid Traditional Name: 4-chloro-3-[[2-(dimethylaminomethyl)benzyl]sulfamoyl]benzoic acid Formula: C17H19ClN2O4S MolecularWeight: 382.86176

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC=C1CNS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)Cl

Isomeric SMILES

CN(C)CC1=CC=CC=C1CNS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)Cl

InChI

InChI=1S/C17H19ClN2O4S/c1-20(2)11-14-6-4-3-5-13(14)10-19-25(23,24)16-9-12(17(21)22)7-8-15(16)18/h3-9,19H,10-11H2,1-2H3,(H,21,22)