1,1,3-tris(oxidanylidene)-2-[(3S)-2-oxidanylideneoxolan-3-yl]-1,2-benzothiazole-6-carboxylate

Systemtic Name: 1,1,3-tris(oxidanylidene)-2-[(3S)-2-oxidanylideneoxolan-3-yl]-1,2-benzothiazole-6-carboxylate Openeye Name: 1,1,3-trioxo-2-[(3S)-2-oxotetrahydrofuran-3-yl]-1,2-benzothiazole-6-carboxylate CAS Name: 1,1,3-trioxo-2-[(3S)-2-oxo-3-oxolanyl]-1,2-benzothiazole-6-carboxylate IUPAC Name: 1,1,3-trioxo-2-[(3S)-2-oxooxolan-3-yl]-1,2-benzothiazole-6-carboxylate Traditional Name: 1,1,3-triketo-2-[(3S)-2-ketotetrahydrofuran-3-yl]-1,2-benzothiazole-6-carboxylate Formula: C12H8NO7S- MolecularWeight: 310.25942

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)C1N2C(=O)C3=C(S2(=O)=O)C=C(C=C3)C(=O)[O-]

Isomeric SMILES

C1COC(=O)[C@H]1N2C(=O)C3=C(S2(=O)=O)C=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C12H9NO7S/c14-10-7-2-1-6(11(15)16)5-9(7)21(18,19)13(10)8-3-4-20-12(8)17/h1-2,5,8H,3-4H2,(H,15,16)/p-1/t8-/m0/s1