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

Systemtic Name: ethyl 5-[(2-ethoxy-2-oxidanylidene-ethanoyl)amino]-3-methyl-4-nitro-thiophene-2-carboxylate Openeye Name: ethyl 5-[(2-ethoxy-2-oxo-acetyl)amino]-3-methyl-4-nitro-thiophene-2-carboxylate CAS Name: 5-[(2-ethoxy-1,2-dioxoethyl)amino]-3-methyl-4-nitro-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2-ethoxy-2-oxoacetyl)amino]-3-methyl-4-nitrothiophene-2-carboxylate Traditional Name: 5-(ethoxalylamino)-3-methyl-4-nitro-thiophene-2-carboxylic acid ethyl ester Formula: C12H14N2O7S MolecularWeight: 330.31376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C(=O)OCC)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C(=O)OCC)[N+](=O)[O-])C

InChI

InChI=1S/C12H14N2O7S/c1-4-20-11(16)8-6(3)7(14(18)19)10(22-8)13-9(15)12(17)21-5-2/h4-5H2,1-3H3,(H,13,15)