2-(carboxycarbonylamino)-6-phenylmethoxycarbonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid

Systemtic Name: 2-(carboxycarbonylamino)-6-phenylmethoxycarbonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid Openeye Name: 6-benzyloxycarbonyl-2-(oxaloamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid CAS Name: 2-(oxaloamino)-6-phenylmethoxycarbonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid IUPAC Name: 2-(oxaloamino)-6-phenylmethoxycarbonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid Traditional Name: 6-carbobenzoxy-2-(oxaloamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid Formula: C18H16N2O7S MolecularWeight: 404.39384

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C(=C(S2)NC(=O)C(=O)O)C(=O)O)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CN(CC2=C1C(=C(S2)NC(=O)C(=O)O)C(=O)O)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C18H16N2O7S/c21-14(17(24)25)19-15-13(16(22)23)11-6-7-20(8-12(11)28-15)18(26)27-9-10-4-2-1-3-5-10/h1-5H,6-9H2,(H,19,21)(H,22,23)(H,24,25)