ethyl (5Z)-2-[(4-ethoxyphenyl)amino]-5-[(3-methoxy-4-oxidanyl-5-prop-2-enyl-phenyl)methylidene]-4-oxidanylidene-thiophene-3-carboxylate

Systemtic Name: ethyl (5Z)-2-[(4-ethoxyphenyl)amino]-5-[(3-methoxy-4-oxidanyl-5-prop-2-enyl-phenyl)methylidene]-4-oxidanylidene-thiophene-3-carboxylate Openeye Name: ethyl (5Z)-5-[(3-allyl-4-hydroxy-5-methoxy-phenyl)methylene]-2-(4-ethoxyanilino)-4-oxo-thiophene-3-carboxylate CAS Name: (5Z)-2-(4-ethoxyanilino)-5-[(4-hydroxy-3-methoxy-5-prop-2-enylphenyl)methylidene]-4-oxo-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl (5Z)-2-(4-ethoxyanilino)-5-[(4-hydroxy-3-methoxy-5-prop-2-enylphenyl)methylidene]-4-oxothiophene-3-carboxylate Traditional Name: (5Z)-5-(3-allyl-4-hydroxy-5-methoxy-benzylidene)-4-keto-2-(p-phenetidino)thiophene-3-carboxylic acid ethyl ester Formula: C26H27NO6S MolecularWeight: 481.56068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=C(C(=O)C(=CC3=CC(=C(C(=C3)OC)O)CC=C)S2)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=C(C(=O)/C(=C/C3=CC(=C(C(=C3)OC)O)CC=C)/S2)C(=O)OCC

InChI

InChI=1S/C26H27NO6S/c1-5-8-17-13-16(14-20(31-4)23(17)28)15-21-24(29)22(26(30)33-7-3)25(34-21)27-18-9-11-19(12-10-18)32-6-2/h5,9-15,27-28H,1,6-8H2,2-4H3/b21-15-