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

Systemtic Name: ethyl 5-nitro-2-[(3,4,5-trimethoxyphenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-nitro-2-[(3,4,5-trimethoxybenzoyl)amino]thiophene-3-carboxylate CAS Name: 5-nitro-2-[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-nitro-2-[(3,4,5-trimethoxybenzoyl)amino]thiophene-3-carboxylate Traditional Name: 5-nitro-2-[(3,4,5-trimethoxybenzoyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C17H18N2O8S MolecularWeight: 410.39842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O8S/c1-5-27-17(21)10-8-13(19(22)23)28-16(10)18-15(20)9-6-11(24-2)14(26-4)12(7-9)25-3/h6-8H,5H2,1-4H3,(H,18,20)