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

Systemtic Name: 6-[(3,4-dimethoxyphenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylate Openeye Name: 6-[(3,4-dimethoxyphenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylate CAS Name: 6-[(3,4-dimethoxyphenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxin-7-carboxylate IUPAC Name: 6-[(3,4-dimethoxyphenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylate Traditional Name: 6-[(3,4-dimethoxyphenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxin-7-carboxylate Formula: C17H16NO8S- MolecularWeight: 394.37584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2C(=O)[O-])OCCO3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2C(=O)[O-])OCCO3)OC

InChI

InChI=1S/C17H17NO8S/c1-23-13-4-3-10(7-14(13)24-2)27(21,22)18-12-9-16-15(25-5-6-26-16)8-11(12)17(19)20/h3-4,7-9,18H,5-6H2,1-2H3,(H,19,20)/p-1