3-(3-aminophenyl)sulfonylaniline; 6,7-diaminocarbonyl-1,3-bis(oxidanylidene)-2-benzofuran-5-carboxylic acid

Systemtic Name: 3-(3-aminophenyl)sulfonylaniline; 6,7-diaminocarbonyl-1,3-bis(oxidanylidene)-2-benzofuran-5-carboxylic acid Openeye Name: 3-(3-aminophenyl)sulfonylaniline; 6,7-dicarbamoyl-1,3-dioxo-isobenzofuran-5-carboxylic acid CAS Name: 3-(3-aminophenyl)sulfonylaniline; 6,7-dicarbamoyl-1,3-dioxo-5-isobenzofurancarboxylic acid IUPAC Name: 3-(3-aminophenyl)sulfonylaniline; 6,7-dicarbamoyl-1,3-dioxo-2-benzofuran-5-carboxylic acid Traditional Name: [3-(3-aminophenyl)sulfonylphenyl]amine; 6,7-dicarbamoyl-1,3-diketo-phthalan-5-carboxylic acid Formula: C23H18N4O9S MolecularWeight: 526.47542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)C2=CC=CC(=C2)N)N.C1=C2C(=C(C(=C1C(=O)O)C(=O)N)C(=O)N)C(=O)OC2=O

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)C2=CC=CC(=C2)N)N.C1=C2C(=C(C(=C1C(=O)O)C(=O)N)C(=O)N)C(=O)OC2=O

InChI

InChI=1S/C12H12N2O2S.C11H6N2O7/c13-9-3-1-5-11(7-9)17(15,16)12-6-2-4-10(14)8-12;12-7(14)4-2(9(16)17)1-3-5(6(4)8(13)15)11(19)20-10(3)18/h1-8H,13-14H2;1H,(H2,12,14)(H2,13,15)(H,16,17)