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

Systemtic Name: dimethyl 5-azanyl-3-[2-(2-nitrophenyl)ethanoyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[[2-(2-nitrophenyl)acetyl]oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[2-(2-nitrophenyl)-1-oxoethoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[[2-(2-nitrophenyl)acetyl]oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[2-(2-nitrophenyl)acetyl]oxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C17H16N2O8S MolecularWeight: 408.38254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1COC(=O)CC2=CC=CC=C2[N+](=O)[O-])C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(SC(=C1COC(=O)CC2=CC=CC=C2[N+](=O)[O-])C(=O)OC)N

InChI

InChI=1S/C17H16N2O8S/c1-25-16(21)13-10(14(17(22)26-2)28-15(13)18)8-27-12(20)7-9-5-3-4-6-11(9)19(23)24/h3-6H,7-8,18H2,1-2H3