3-(carboxycarbonylamino)-5-(3-nitrophenyl)thiophene-2-carboxylic acid

Systemtic Name: 3-(carboxycarbonylamino)-5-(3-nitrophenyl)thiophene-2-carboxylic acid Openeye Name: 5-(3-nitrophenyl)-3-(oxaloamino)thiophene-2-carboxylic acid CAS Name: 5-(3-nitrophenyl)-3-(oxaloamino)-2-thiophenecarboxylic acid IUPAC Name: 5-(3-nitrophenyl)-3-(oxaloamino)thiophene-2-carboxylic acid Traditional Name: 5-(3-nitrophenyl)-3-(oxaloamino)-2-thenoic acid Formula: C13H8N2O7S MolecularWeight: 336.27682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC(=C(S2)C(=O)O)NC(=O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC(=C(S2)C(=O)O)NC(=O)C(=O)O

InChI

InChI=1S/C13H8N2O7S/c16-11(13(19)20)14-8-5-9(23-10(8)12(17)18)6-2-1-3-7(4-6)15(21)22/h1-5H,(H,14,16)(H,17,18)(H,19,20)