3-[4-(1,3-benzodioxol-5-ylsulfamoyl)phenyl]propanoate

Systemtic Name: 3-[4-(1,3-benzodioxol-5-ylsulfamoyl)phenyl]propanoate Openeye Name: 3-[4-(1,3-benzodioxol-5-ylsulfamoyl)phenyl]propanoate CAS Name: 3-[4-(1,3-benzodioxol-5-ylsulfamoyl)phenyl]propanoate IUPAC Name: 3-[4-(1,3-benzodioxol-5-ylsulfamoyl)phenyl]propanoate Traditional Name: 3-[4-(1,3-benzodioxol-5-ylsulfamoyl)phenyl]propionate Formula: C16H14NO6S- MolecularWeight: 348.35046

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)CCC(=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)CCC(=O)[O-]

InChI

InChI=1S/C16H15NO6S/c18-16(19)8-3-11-1-5-13(6-2-11)24(20,21)17-12-4-7-14-15(9-12)23-10-22-14/h1-2,4-7,9,17H,3,8,10H2,(H,18,19)/p-1