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

Systemtic Name: 6-[(3-methoxycarbonylphenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylic acid Openeye Name: 6-[(3-methoxycarbonylphenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylic acid CAS Name: 6-[(3-methoxycarbonylphenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid IUPAC Name: 6-[(3-methoxycarbonylphenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylic acid Traditional Name: 6-[(3-carbomethoxyphenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid Formula: C17H15NO8S MolecularWeight: 393.3679

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15NO8S/c1-24-17(21)10-3-2-4-11(7-10)27(22,23)18-13-9-15-14(25-5-6-26-15)8-12(13)16(19)20/h2-4,7-9,18H,5-6H2,1H3,(H,19,20)