3-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]benzoic acid

Systemtic Name: 3-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]benzoic acid Openeye Name: 3-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]benzoic acid CAS Name: 3-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 3-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]benzoic acid Traditional Name: 3-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]benzoic acid Formula: C16H15NO4S3 MolecularWeight: 381.4896

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(S1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)O

Isomeric SMILES

C1CSC(S1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C16H15NO4S3/c18-15(19)12-2-1-3-14(10-12)24(20,21)17-13-6-4-11(5-7-13)16-22-8-9-23-16/h1-7,10,16-17H,8-9H2,(H,18,19)