ethyl 4,5-dimethyl-2-[2-(4-morpholin-4-yl-3-nitro-phenyl)carbonyloxyethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-[2-(4-morpholin-4-yl-3-nitro-phenyl)carbonyloxyethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[[2-(4-morpholino-3-nitro-benzoyl)oxyacetyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[2-[[4-(4-morpholinyl)-3-nitrophenyl]-oxomethoxy]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[[2-(4-morpholin-4-yl-3-nitrobenzoyl)oxyacetyl]amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[[2-(4-morpholino-3-nitro-benzoyl)oxyacetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C22H25N3O8S MolecularWeight: 491.5142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)COC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)COC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C22H25N3O8S/c1-4-32-22(28)19-13(2)14(3)34-20(19)23-18(26)12-33-21(27)15-5-6-16(17(11-15)25(29)30)24-7-9-31-10-8-24/h5-6,11H,4,7-10,12H2,1-3H3,(H,23,26)