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

Systemtic Name: 4-chloranyl-3-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]benzoic acid Openeye Name: 4-chloro-3-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]benzoic acid CAS Name: 4-chloro-3-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 4-chloro-3-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]benzoic acid Traditional Name: 4-chloro-3-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]benzoic acid Formula: C16H14ClNO4S3 MolecularWeight: 415.93466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14ClNO4S3/c17-13-6-3-11(15(19)20)9-14(13)25(21,22)18-12-4-1-10(2-5-12)16-23-7-8-24-16/h1-6,9,16,18H,7-8H2,(H,19,20)