5-[(1,3-benzodioxol-5-ylcarbonylamino)sulfamoyl]-2-chloranyl-benzoic acid

Systemtic Name: 5-[(1,3-benzodioxol-5-ylcarbonylamino)sulfamoyl]-2-chloranyl-benzoic acid Openeye Name: 5-[(1,3-benzodioxole-5-carbonylamino)sulfamoyl]-2-chloro-benzoic acid CAS Name: 5-[[[1,3-benzodioxol-5-yl(oxo)methyl]amino]sulfamoyl]-2-chlorobenzoic acid IUPAC Name: 5-[(1,3-benzodioxole-5-carbonylamino)sulfamoyl]-2-chlorobenzoic acid Traditional Name: 2-chloro-5-[(piperonyloylamino)sulfamoyl]benzoic acid Formula: C15H11ClN2O7S MolecularWeight: 398.77504

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NNS(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NNS(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C15H11ClN2O7S/c16-11-3-2-9(6-10(11)15(20)21)26(22,23)18-17-14(19)8-1-4-12-13(5-8)25-7-24-12/h1-6,18H,7H2,(H,17,19)(H,20,21)