ethyl 5-nitro-2-[(3,4,5-triethoxyphenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-nitro-2-[(3,4,5-triethoxyphenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-nitro-2-[(3,4,5-triethoxybenzoyl)amino]thiophene-3-carboxylate CAS Name: 5-nitro-2-[[oxo-(3,4,5-triethoxyphenyl)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-nitro-2-[(3,4,5-triethoxybenzoyl)amino]thiophene-3-carboxylate Traditional Name: 5-nitro-2-[(3,4,5-triethoxybenzoyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C20H24N2O8S MolecularWeight: 452.47816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=C(C=C(S2)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=C(C=C(S2)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C20H24N2O8S/c1-5-27-14-9-12(10-15(28-6-2)17(14)29-7-3)18(23)21-19-13(20(24)30-8-4)11-16(31-19)22(25)26/h9-11H,5-8H2,1-4H3,(H,21,23)