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

Systemtic Name: ethyl 5-ethyl-2-[2-(4-methoxy-3-nitro-phenyl)carbonyloxyethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[[2-(4-methoxy-3-nitro-benzoyl)oxyacetyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[2-[(4-methoxy-3-nitrophenyl)-oxomethoxy]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[[2-(4-methoxy-3-nitrobenzoyl)oxyacetyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[2-(4-methoxy-3-nitro-benzoyl)oxyacetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C19H20N2O8S MolecularWeight: 436.4357

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O8S/c1-4-12-9-13(19(24)28-5-2)17(30-12)20-16(22)10-29-18(23)11-6-7-15(27-3)14(8-11)21(25)26/h6-9H,4-5,10H2,1-3H3,(H,20,22)