6-[(2-methoxycarbonylthiophen-3-yl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylic acid

Systemtic Name: 6-[(2-methoxycarbonylthiophen-3-yl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylic acid Openeye Name: 6-[(2-methoxycarbonyl-3-thienyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylic acid CAS Name: 6-[(2-methoxycarbonyl-3-thiophenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid IUPAC Name: 6-[(2-methoxycarbonylthiophen-3-yl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylic acid Traditional Name: 6-[(2-carbomethoxy-3-thienyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid Formula: C15H13NO8S2 MolecularWeight: 399.39562

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=CC3=C(C=C2C(=O)O)OCCO3

Isomeric SMILES

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=CC3=C(C=C2C(=O)O)OCCO3

InChI

InChI=1S/C15H13NO8S2/c1-22-15(19)13-12(2-5-25-13)26(20,21)16-9-7-11-10(23-3-4-24-11)6-8(9)14(17)18/h2,5-7,16H,3-4H2,1H3,(H,17,18)