dimethyl 5-azanyl-3-[2-(2-nitrophenoxy)ethanoyloxymethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[2-(2-nitrophenoxy)ethanoyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[[2-(2-nitrophenoxy)acetyl]oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[2-(2-nitrophenoxy)-1-oxoethoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[[2-(2-nitrophenoxy)acetyl]oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[2-(2-nitrophenoxy)acetyl]oxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C17H16N2O9S MolecularWeight: 424.38194

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1COC(=O)COC2=CC=CC=C2[N+](=O)[O-])C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(SC(=C1COC(=O)COC2=CC=CC=C2[N+](=O)[O-])C(=O)OC)N

InChI

InChI=1S/C17H16N2O9S/c1-25-16(21)13-9(14(17(22)26-2)29-15(13)18)7-28-12(20)8-27-11-6-4-3-5-10(11)19(23)24/h3-6H,7-8,18H2,1-2H3