ethyl (5Z)-2-[(4-methoxyphenyl)amino]-5-[(3-nitrophenyl)methylidene]-4-oxidanylidene-thiophene-3-carboxylate

Systemtic Name: ethyl (5Z)-2-[(4-methoxyphenyl)amino]-5-[(3-nitrophenyl)methylidene]-4-oxidanylidene-thiophene-3-carboxylate Openeye Name: ethyl (5Z)-2-(4-methoxyanilino)-5-[(3-nitrophenyl)methylene]-4-oxo-thiophene-3-carboxylate CAS Name: (5Z)-2-(4-methoxyanilino)-5-[(3-nitrophenyl)methylidene]-4-oxo-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl (5Z)-2-(4-methoxyanilino)-5-[(3-nitrophenyl)methylidene]-4-oxothiophene-3-carboxylate Traditional Name: (5Z)-4-keto-5-(3-nitrobenzylidene)-2-(p-anisidino)thiophene-3-carboxylic acid ethyl ester Formula: C21H18N2O6S MolecularWeight: 426.44242

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=CC2=CC(=CC=C2)[N+](=O)[O-])C1=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C1=C(S/C(=C\C2=CC(=CC=C2)[N+](=O)[O-])/C1=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H18N2O6S/c1-3-29-21(25)18-19(24)17(12-13-5-4-6-15(11-13)23(26)27)30-20(18)22-14-7-9-16(28-2)10-8-14/h4-12,22H,3H2,1-2H3/b17-12-