6-[(3-sulfamoylphenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylate

Systemtic Name: 6-[(3-sulfamoylphenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylate Openeye Name: 6-[(3-sulfamoylphenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylate CAS Name: 6-[(3-sulfamoylphenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxin-7-carboxylate IUPAC Name: 6-[(3-sulfamoylphenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylate Traditional Name: 6-[(3-sulfamoylphenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxin-7-carboxylate Formula: C15H13N2O8S2- MolecularWeight: 413.40232

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)NS(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)N)C(=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)NS(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)N)C(=O)[O-]

InChI

InChI=1S/C15H14N2O8S2/c16-26(20,21)9-2-1-3-10(6-9)27(22,23)17-12-8-14-13(24-4-5-25-14)7-11(12)15(18)19/h1-3,6-8,17H,4-5H2,(H,18,19)(H2,16,20,21)/p-1