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

Systemtic Name: 6-[(4-morpholin-4-ylsulfonylphenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylate Openeye Name: 6-[(4-morpholinosulfonylphenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylate CAS Name: 6-[[4-(4-morpholinylsulfonyl)phenyl]sulfonylamino]-2,3-dihydro-1,4-benzodioxin-7-carboxylate IUPAC Name: 6-[(4-morpholin-4-ylsulfonylphenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylate Traditional Name: 6-[(4-morpholinosulfonylphenyl)sulfonylamino]-2,3-dihydro-1,4-benzodioxin-7-carboxylate Formula: C19H19N2O9S2- MolecularWeight: 483.49216

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC4=C(C=C3C(=O)[O-])OCCO4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC4=C(C=C3C(=O)[O-])OCCO4

InChI

InChI=1S/C19H20N2O9S2/c22-19(23)15-11-17-18(30-10-9-29-17)12-16(15)20-31(24,25)13-1-3-14(4-2-13)32(26,27)21-5-7-28-8-6-21/h1-4,11-12,20H,5-10H2,(H,22,23)/p-1