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

Systemtic Name: diethyl 3-methyl-5-[2-(4-methyl-3,5-dinitro-phenyl)carbonyloxyethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[2-(4-methyl-3,5-dinitro-benzoyl)oxyacetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-[(4-methyl-3,5-dinitrophenyl)-oxomethoxy]-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[2-(4-methyl-3,5-dinitrobenzoyl)oxyacetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(4-methyl-3,5-dinitro-benzoyl)oxyacetyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C21H21N3O11S MolecularWeight: 523.46994

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C21H21N3O11S/c1-5-33-20(27)16-11(4)17(21(28)34-6-2)36-18(16)22-15(25)9-35-19(26)12-7-13(23(29)30)10(3)14(8-12)24(31)32/h7-8H,5-6,9H2,1-4H3,(H,22,25)