2-(carboxycarbonylamino)-5-(phenylcarbamoyl)-3aH-thieno[2,3-c]pyran-3-carboxylic acid

Systemtic Name: 2-(carboxycarbonylamino)-5-(phenylcarbamoyl)-3aH-thieno[2,3-c]pyran-3-carboxylic acid Openeye Name: 2-(oxaloamino)-5-(phenylcarbamoyl)-3aH-thieno[2,3-c]pyran-3-carboxylic acid CAS Name: 5-[anilino(oxo)methyl]-2-(oxaloamino)-3aH-thieno[2,3-c]pyran-3-carboxylic acid IUPAC Name: 2-(oxaloamino)-5-(phenylcarbamoyl)-3aH-thieno[2,3-c]pyran-3-carboxylic acid Traditional Name: 2-(oxaloamino)-5-(phenylcarbamoyl)-3aH-thieno[2,3-c]pyran-3-carboxylic acid Formula: C17H12N2O7S MolecularWeight: 388.35138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=CC3C(=CO2)SC(=C3C(=O)O)NC(=O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=CC3C(=CO2)SC(=C3C(=O)O)NC(=O)C(=O)O

InChI

InChI=1S/C17H12N2O7S/c20-13(18-8-4-2-1-3-5-8)10-6-9-11(7-26-10)27-15(12(9)16(22)23)19-14(21)17(24)25/h1-7,9H,(H,18,20)(H,19,21)(H,22,23)(H,24,25)