2-(carboxycarbonylamino)-5-(phenylcarbonyloxymethyl)-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylic acid

Systemtic Name: 2-(carboxycarbonylamino)-5-(phenylcarbonyloxymethyl)-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylic acid Openeye Name: 5-(benzoyloxymethyl)-2-(oxaloamino)-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylic acid CAS Name: 5-(benzoyloxymethyl)-2-(oxaloamino)-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylic acid IUPAC Name: 5-(benzoyloxymethyl)-2-(oxaloamino)-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylic acid Traditional Name: 5-(benzoyloxymethyl)-2-(oxaloamino)-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylic acid Formula: C18H15NO8S MolecularWeight: 405.3786

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OCC2=C1C(=C(S2)NC(=O)C(=O)O)C(=O)O)COC(=O)C3=CC=CC=C3

Isomeric SMILES

C1C(OCC2=C1C(=C(S2)NC(=O)C(=O)O)C(=O)O)COC(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H15NO8S/c20-14(17(23)24)19-15-13(16(21)22)11-6-10(26-8-12(11)28-15)7-27-18(25)9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H,19,20)(H,21,22)(H,23,24)