ethyl 5-ethyl-4-methyl-2-[2-(2-nitrophenoxy)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-4-methyl-2-[2-(2-nitrophenoxy)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-4-methyl-2-[[2-(2-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-4-methyl-2-[[2-(2-nitrophenoxy)-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-4-methyl-2-[[2-(2-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-4-methyl-2-[[2-(2-nitrophenoxy)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C18H20N2O6S MolecularWeight: 392.4262

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(S1)NC(=O)COC2=CC=CC=C2[N+](=O)[O-])C(=O)OCC)C

Isomeric SMILES

CCC1=C(C(=C(S1)NC(=O)COC2=CC=CC=C2[N+](=O)[O-])C(=O)OCC)C

InChI

InChI=1S/C18H20N2O6S/c1-4-14-11(3)16(18(22)25-5-2)17(27-14)19-15(21)10-26-13-9-7-6-8-12(13)20(23)24/h6-9H,4-5,10H2,1-3H3,(H,19,21)