ethyl 5-[(3-ethoxy-5-nitro-2-oxidanyl-phenyl)methylidene]-2-[(4-methylphenyl)carbonylamino]-4-oxidanylidene-thiophene-3-carboxylate

Systemtic Name: ethyl 5-[(3-ethoxy-5-nitro-2-oxidanyl-phenyl)methylidene]-2-[(4-methylphenyl)carbonylamino]-4-oxidanylidene-thiophene-3-carboxylate Openeye Name: ethyl 5-[(3-ethoxy-2-hydroxy-5-nitro-phenyl)methylene]-2-[(4-methylbenzoyl)amino]-4-oxo-thiophene-3-carboxylate CAS Name: 5-[(3-ethoxy-2-hydroxy-5-nitrophenyl)methylidene]-2-[[(4-methylphenyl)-oxomethyl]amino]-4-oxo-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(3-ethoxy-2-hydroxy-5-nitrophenyl)methylidene]-2-[(4-methylbenzoyl)amino]-4-oxothiophene-3-carboxylate Traditional Name: 5-(3-ethoxy-2-hydroxy-5-nitro-benzylidene)-4-keto-2-(p-toluoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C24H22N2O8S MolecularWeight: 498.50508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)[N+](=O)[O-])C=C2C(=O)C(=C(S2)NC(=O)C3=CC=C(C=C3)C)C(=O)OCC)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)[N+](=O)[O-])C=C2C(=O)C(=C(S2)NC(=O)C3=CC=C(C=C3)C)C(=O)OCC)O

InChI

InChI=1S/C24H22N2O8S/c1-4-33-17-12-16(26(31)32)10-15(20(17)27)11-18-21(28)19(24(30)34-5-2)23(35-18)25-22(29)14-8-6-13(3)7-9-14/h6-12,27H,4-5H2,1-3H3,(H,25,29)