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

Systemtic Name: 3-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]-4-methoxy-benzoic acid Openeye Name: 3-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]-4-methoxy-benzoic acid CAS Name: 3-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]-4-methoxybenzoic acid IUPAC Name: 3-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]-4-methoxybenzoic acid Traditional Name: 3-[[4-(1,3-dithiolan-2-yl)phenyl]sulfamoyl]-4-methoxy-benzoic acid Formula: C17H17NO5S3 MolecularWeight: 411.51558

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=CC=C(C=C2)C3SCCS3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=CC=C(C=C2)C3SCCS3

InChI

InChI=1S/C17H17NO5S3/c1-23-14-7-4-12(16(19)20)10-15(14)26(21,22)18-13-5-2-11(3-6-13)17-24-8-9-25-17/h2-7,10,17-18H,8-9H2,1H3,(H,19,20)