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

Systemtic Name: 6-[(4-carboxylatophenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylate Openeye Name: 6-[(4-carboxylatophenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylate CAS Name: 6-[(4-carboxylatophenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxin-7-carboxylate IUPAC Name: 6-[(4-carboxylatophenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylate Traditional Name: 6-[(4-carboxylatophenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxin-7-carboxylate Formula: C16H11NO8S-2 MolecularWeight: 377.32544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13NO8S/c18-15(19)9-1-3-10(4-2-9)26(22,23)17-12-8-14-13(24-5-6-25-14)7-11(12)16(20)21/h1-4,7-8,17H,5-6H2,(H,18,19)(H,20,21)/p-2