6-[[2,5-bis(methoxycarbonyl)phenyl]sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylate

Systemtic Name: 6-[[2,5-bis(methoxycarbonyl)phenyl]sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylate Openeye Name: 6-[[2,5-bis(methoxycarbonyl)phenyl]sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylate CAS Name: 6-[[2,5-bis(methoxycarbonyl)phenyl]sulfonylamino]-2,3-dihydro-1,4-benzodioxin-7-carboxylate IUPAC Name: 6-[[2,5-bis(methoxycarbonyl)phenyl]sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylate Traditional Name: 6-[(2,5-dicarbomethoxyphenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxin-7-carboxylate Formula: C19H16NO10S- MolecularWeight: 450.39604

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)S(=O)(=O)NC2=CC3=C(C=C2C(=O)[O-])OCCO3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)S(=O)(=O)NC2=CC3=C(C=C2C(=O)[O-])OCCO3

InChI

InChI=1S/C19H17NO10S/c1-27-18(23)10-3-4-11(19(24)28-2)16(7-10)31(25,26)20-13-9-15-14(29-5-6-30-15)8-12(13)17(21)22/h3-4,7-9,20H,5-6H2,1-2H3,(H,21,22)/p-1