diethyl 3-methyl-5-[2-(3-methyl-4-nitro-phenoxy)ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[2-(3-methyl-4-nitro-phenoxy)ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[2-(3-methyl-4-nitro-phenoxy)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-(3-methyl-4-nitrophenoxy)-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[2-(3-methyl-4-nitrophenoxy)acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(3-methyl-4-nitro-phenoxy)acetyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C20H22N2O8S MolecularWeight: 450.46228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)COC2=CC(=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)COC2=CC(=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C20H22N2O8S/c1-5-28-19(24)16-12(4)17(20(25)29-6-2)31-18(16)21-15(23)10-30-13-7-8-14(22(26)27)11(3)9-13/h7-9H,5-6,10H2,1-4H3,(H,21,23)