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

Systemtic Name: ethyl 4-(3-nitrophenyl)-2-[(3,4,5-triethoxyphenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(3-nitrophenyl)-2-[(3,4,5-triethoxybenzoyl)amino]thiophene-3-carboxylate CAS Name: 4-(3-nitrophenyl)-2-[[oxo-(3,4,5-triethoxyphenyl)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-nitrophenyl)-2-[(3,4,5-triethoxybenzoyl)amino]thiophene-3-carboxylate Traditional Name: 4-(3-nitrophenyl)-2-[(3,4,5-triethoxybenzoyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C26H28N2O8S MolecularWeight: 528.57412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=C(C(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=C(C(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C26H28N2O8S/c1-5-33-20-13-17(14-21(34-6-2)23(20)35-7-3)24(29)27-25-22(26(30)36-8-4)19(15-37-25)16-10-9-11-18(12-16)28(31)32/h9-15H,5-8H2,1-4H3,(H,27,29)