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

Systemtic Name: ethyl (5Z)-5-[(3-bromophenyl)methylidene]-2-[(4-nitrophenyl)amino]-4-oxidanylidene-thiophene-3-carboxylate Openeye Name: ethyl (5Z)-5-[(3-bromophenyl)methylene]-2-(4-nitroanilino)-4-oxo-thiophene-3-carboxylate CAS Name: (5Z)-5-[(3-bromophenyl)methylidene]-2-(4-nitroanilino)-4-oxo-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl (5Z)-5-[(3-bromophenyl)methylidene]-2-(4-nitroanilino)-4-oxothiophene-3-carboxylate Traditional Name: (5Z)-5-(3-bromobenzylidene)-4-keto-2-(4-nitroanilino)thiophene-3-carboxylic acid ethyl ester Formula: C20H15BrN2O5S MolecularWeight: 475.3125

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15BrN2O5S/c1-2-28-20(25)17-18(24)16(11-12-4-3-5-13(21)10-12)29-19(17)22-14-6-8-15(9-7-14)23(26)27/h3-11,22H,2H2,1H3/b16-11-