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

Systemtic Name: 6-[(2-nitrophenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylic acid Openeye Name: 6-[(2-nitrophenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylic acid CAS Name: 6-[(2-nitrophenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid IUPAC Name: 6-[(2-nitrophenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylic acid Traditional Name: 6-[(2-nitrophenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid Formula: C15H12N2O8S MolecularWeight: 380.32938

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C15H12N2O8S/c18-15(19)9-7-12-13(25-6-5-24-12)8-10(9)16-26(22,23)14-4-2-1-3-11(14)17(20)21/h1-4,7-8,16H,5-6H2,(H,18,19)