ethyl 4-(3-nitrophenyl)-2-[(2-oxidanylidenechromen-3-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(3-nitrophenyl)-2-[(2-oxidanylidenechromen-3-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(3-nitrophenyl)-2-[(2-oxochromene-3-carbonyl)amino]thiophene-3-carboxylate CAS Name: 4-(3-nitrophenyl)-2-[[oxo-(2-oxo-1-benzopyran-3-yl)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-nitrophenyl)-2-[(2-oxochromene-3-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 2-[(2-ketochromene-3-carbonyl)amino]-4-(3-nitrophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C23H16N2O7S MolecularWeight: 464.44734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C23H16N2O7S/c1-2-31-23(28)19-17(13-7-5-8-15(10-13)25(29)30)12-33-21(19)24-20(26)16-11-14-6-3-4-9-18(14)32-22(16)27/h3-12H,2H2,1H3,(H,24,26)