5-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]-2-methyl-benzoic acid

Systemtic Name: 5-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]-2-methyl-benzoic acid Openeye Name: 5-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]-2-methyl-benzoic acid CAS Name: 5-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]-2-methylbenzoic acid IUPAC Name: 5-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]-2-methylbenzoic acid Traditional Name: 5-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]-2-methyl-benzoic acid Formula: C17H17NO4S3 MolecularWeight: 395.51618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3SCCS3)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3SCCS3)C(=O)O

InChI

InChI=1S/C17H17NO4S3/c1-11-2-7-14(10-15(11)16(19)20)25(21,22)18-13-5-3-12(4-6-13)17-23-8-9-24-17/h2-7,10,17-18H,8-9H2,1H3,(H,19,20)