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

Systemtic Name: ethyl (5Z)-5-[(3-nitrophenyl)methylidene]-4-oxidanylidene-2-phenylazanyl-thiophene-3-carboxylate Openeye Name: ethyl (5Z)-2-anilino-5-[(3-nitrophenyl)methylene]-4-oxo-thiophene-3-carboxylate CAS Name: (5Z)-2-anilino-5-[(3-nitrophenyl)methylidene]-4-oxo-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl (5Z)-2-anilino-5-[(3-nitrophenyl)methylidene]-4-oxothiophene-3-carboxylate Traditional Name: (5Z)-2-anilino-4-keto-5-(3-nitrobenzylidene)thiophene-3-carboxylic acid ethyl ester Formula: C20H16N2O5S MolecularWeight: 396.41644

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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=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C20H16N2O5S/c1-2-27-20(24)17-18(23)16(12-13-7-6-10-15(11-13)22(25)26)28-19(17)21-14-8-4-3-5-9-14/h3-12,21H,2H2,1H3/b16-12-