6-(carboxycarbonylamino)-2-(carboxycarbonyloxymethyl)-4a,7a-dihydro-4H-thieno[2,3-b]pyran-5-carboxylic acid

Systemtic Name: 6-(carboxycarbonylamino)-2-(carboxycarbonyloxymethyl)-4a,7a-dihydro-4H-thieno[2,3-b]pyran-5-carboxylic acid Openeye Name: 6-(oxaloamino)-2-(oxalooxymethyl)-4a,7a-dihydro-4H-thieno[2,3-b]pyran-5-carboxylic acid CAS Name: 6-(oxaloamino)-2-(oxalooxymethyl)-4a,7a-dihydro-4H-thieno[2,3-b]pyran-5-carboxylic acid IUPAC Name: 6-(oxaloamino)-2-(oxalooxymethyl)-4a,7a-dihydro-4H-thieno[2,3-b]pyran-5-carboxylic acid Traditional Name: 6-(oxaloamino)-2-(oxalooxymethyl)-4a,7a-dihydro-4H-thieno[2,3-b]pyran-5-carboxylic acid Formula: C13H11NO10S MolecularWeight: 373.29214

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(OC2C1C(=C(S2)NC(=O)C(=O)O)C(=O)O)COC(=O)C(=O)O

Isomeric SMILES

C1C=C(OC2C1C(=C(S2)NC(=O)C(=O)O)C(=O)O)COC(=O)C(=O)O

InChI

InChI=1S/C13H11NO10S/c15-7(10(18)19)14-8-6(9(16)17)5-2-1-4(24-13(5)25-8)3-23-12(22)11(20)21/h1,5,13H,2-3H2,(H,14,15)(H,16,17)(H,18,19)(H,20,21)