dimethyl 3-(2-methoxy-2-oxidanylidene-ethyl)-5-[2-(2-nitropyridin-3-yl)oxyethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-(2-methoxy-2-oxidanylidene-ethyl)-5-[2-(2-nitropyridin-3-yl)oxyethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-(2-methoxy-2-oxo-ethyl)-5-[[2-[(2-nitro-3-pyridyl)oxy]acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-(2-methoxy-2-oxoethyl)-5-[[2-[(2-nitro-3-pyridinyl)oxy]-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-(2-methoxy-2-oxoethyl)-5-[[2-(2-nitropyridin-3-yl)oxyacetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-(2-keto-2-methoxy-ethyl)-5-[[2-[(2-nitro-3-pyridyl)oxy]acetyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C18H17N3O10S MolecularWeight: 467.40668

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=C(SC(=C1C(=O)OC)NC(=O)COC2=C(N=CC=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC(=O)CC1=C(SC(=C1C(=O)OC)NC(=O)COC2=C(N=CC=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H17N3O10S/c1-28-12(23)7-9-13(17(24)29-2)16(32-14(9)18(25)30-3)20-11(22)8-31-10-5-4-6-19-15(10)21(26)27/h4-6H,7-8H2,1-3H3,(H,20,22)