ethyl 5-[(2-ethoxy-2-oxidanylidene-ethanoyl)amino]-3-ethyl-4-nitro-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[(2-ethoxy-2-oxidanylidene-ethanoyl)amino]-3-ethyl-4-nitro-thiophene-2-carboxylate Openeye Name: ethyl 5-[(2-ethoxy-2-oxo-acetyl)amino]-3-ethyl-4-nitro-thiophene-2-carboxylate CAS Name: 5-[(2-ethoxy-1,2-dioxoethyl)amino]-3-ethyl-4-nitro-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2-ethoxy-2-oxoacetyl)amino]-3-ethyl-4-nitrothiophene-2-carboxylate Traditional Name: 5-(ethoxalylamino)-3-ethyl-4-nitro-thiophene-2-carboxylic acid ethyl ester Formula: C13H16N2O7S MolecularWeight: 344.34034

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1[N+](=O)[O-])NC(=O)C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCC1=C(SC(=C1[N+](=O)[O-])NC(=O)C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C13H16N2O7S/c1-4-7-8(15(19)20)11(14-10(16)13(18)22-6-3)23-9(7)12(17)21-5-2/h4-6H2,1-3H3,(H,14,16)