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

Systemtic Name: diethyl 3-methyl-5-[2-[4-(methylamino)-3-nitro-phenyl]carbonyloxyethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[2-[4-(methylamino)-3-nitro-benzoyl]oxyacetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-[[4-(methylamino)-3-nitrophenyl]-oxomethoxy]-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[2-[4-(methylamino)-3-nitrobenzoyl]oxyacetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-[4-(methylamino)-3-nitro-benzoyl]oxyacetyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C21H23N3O9S MolecularWeight: 493.48702

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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)NC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O9S/c1-5-31-20(27)16-11(3)17(21(28)32-6-2)34-18(16)23-15(25)10-33-19(26)12-7-8-13(22-4)14(9-12)24(29)30/h7-9,22H,5-6,10H2,1-4H3,(H,23,25)