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

Systemtic Name: ethyl 5-[(2-ethoxy-2-oxidanylidene-ethanoyl)amino]-4-nitro-3-propyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[(2-ethoxy-2-oxo-acetyl)amino]-4-nitro-3-propyl-thiophene-2-carboxylate CAS Name: 5-[(2-ethoxy-1,2-dioxoethyl)amino]-4-nitro-3-propyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2-ethoxy-2-oxoacetyl)amino]-4-nitro-3-propylthiophene-2-carboxylate Traditional Name: 5-(ethoxalylamino)-4-nitro-3-propyl-thiophene-2-carboxylic acid ethyl ester Formula: C14H18N2O7S MolecularWeight: 358.36692

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(SC(=C1[N+](=O)[O-])NC(=O)C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCCC1=C(SC(=C1[N+](=O)[O-])NC(=O)C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C14H18N2O7S/c1-4-7-8-9(16(20)21)12(15-11(17)14(19)23-6-3)24-10(8)13(18)22-5-2/h4-7H2,1-3H3,(H,15,17)