ethyl (5E)-2-[(3-chlorophenyl)amino]-5-[(3-ethoxy-4-oxidanyl-phenyl)methylidene]-4-oxidanylidene-thiophene-3-carboxylate

Systemtic Name: ethyl (5E)-2-[(3-chlorophenyl)amino]-5-[(3-ethoxy-4-oxidanyl-phenyl)methylidene]-4-oxidanylidene-thiophene-3-carboxylate Openeye Name: ethyl (5E)-2-(3-chloroanilino)-5-[(3-ethoxy-4-hydroxy-phenyl)methylene]-4-oxo-thiophene-3-carboxylate CAS Name: (5E)-2-(3-chloroanilino)-5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl (5E)-2-(3-chloroanilino)-5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-4-oxothiophene-3-carboxylate Traditional Name: (5E)-2-(3-chloroanilino)-5-(3-ethoxy-4-hydroxy-benzylidene)-4-keto-thiophene-3-carboxylic acid ethyl ester Formula: C22H20ClNO5S MolecularWeight: 445.9159

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C2C(=O)C(=C(S2)NC3=CC(=CC=C3)Cl)C(=O)OCC)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/2\C(=O)C(=C(S2)NC3=CC(=CC=C3)Cl)C(=O)OCC)O

InChI

InChI=1S/C22H20ClNO5S/c1-3-28-17-10-13(8-9-16(17)25)11-18-20(26)19(22(27)29-4-2)21(30-18)24-15-7-5-6-14(23)12-15/h5-12,24-25H,3-4H2,1-2H3/b18-11+