diethyl 3-methyl-5-[(4-methyl-3,5-dinitro-phenyl)carbonylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[(4-methyl-3,5-dinitro-phenyl)carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[(4-methyl-3,5-dinitro-benzoyl)amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[(4-methyl-3,5-dinitrophenyl)-oxomethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[(4-methyl-3,5-dinitrobenzoyl)amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[(4-methyl-3,5-dinitro-benzoyl)amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C19H19N3O9S MolecularWeight: 465.43386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O9S/c1-5-30-18(24)14-10(4)15(19(25)31-6-2)32-17(14)20-16(23)11-7-12(21(26)27)9(3)13(8-11)22(28)29/h7-8H,5-6H2,1-4H3,(H,20,23)