ethyl 5-[(3-chloranyl-5-ethoxy-4-oxidanyl-phenyl)methylidene]-4-oxidanylidene-2-phenylazanyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-[(3-chloranyl-5-ethoxy-4-oxidanyl-phenyl)methylidene]-4-oxidanylidene-2-phenylazanyl-thiophene-3-carboxylate Openeye Name: ethyl 2-anilino-5-[(3-chloro-5-ethoxy-4-hydroxy-phenyl)methylene]-4-oxo-thiophene-3-carboxylate CAS Name: 2-anilino-5-[(3-chloro-5-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-anilino-5-[(3-chloro-5-ethoxy-4-hydroxyphenyl)methylidene]-4-oxothiophene-3-carboxylate Traditional Name: 2-anilino-5-(3-chloro-5-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)C(=O)OCC)Cl)O

Isomeric SMILES

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

InChI

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