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

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

CCC1=CC(=C(S1)NC(=O)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)C(=O)OCC

InChI

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