(7E)-7-hydroxyimino-2-morpholin-4-yl-5,6-dihydro-4H-1-benzothiophene-3-sulfonic acid

Systemtic Name: (7E)-7-hydroxyimino-2-morpholin-4-yl-5,6-dihydro-4H-1-benzothiophene-3-sulfonic acid Openeye Name: (7E)-7-hydroxyimino-2-morpholino-5,6-dihydro-4H-benzothiophene-3-sulfonic acid CAS Name: (7E)-7-hydroxyimino-2-(4-morpholinyl)-5,6-dihydro-4H-1-benzothiophene-3-sulfonic acid IUPAC Name: (7E)-7-hydroxyimino-2-morpholin-4-yl-5,6-dihydro-4H-1-benzothiophene-3-sulfonic acid Traditional Name: (7E)-7-hydroximino-2-morpholino-5,6-dihydro-4H-benzothiophene-3-sulfonic acid Formula: C12H16N2O5S2 MolecularWeight: 332.39584

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=NO)C1)SC(=C2S(=O)(=O)O)N3CCOCC3

Isomeric SMILES

C1CC2=C(/C(=N/O)/C1)SC(=C2S(=O)(=O)O)N3CCOCC3

InChI

InChI=1S/C12H16N2O5S2/c15-13-9-3-1-2-8-10(9)20-12(11(8)21(16,17)18)14-4-6-19-7-5-14/h15H,1-7H2,(H,16,17,18)/b13-9+