ethyl 5-[(3-methoxy-4-oxidanyl-phenyl)methylidene]-2-(naphthalen-1-ylamino)-4-oxidanylidene-thiophene-3-carboxylate

Systemtic Name: ethyl 5-[(3-methoxy-4-oxidanyl-phenyl)methylidene]-2-(naphthalen-1-ylamino)-4-oxidanylidene-thiophene-3-carboxylate Openeye Name: ethyl 5-[(4-hydroxy-3-methoxy-phenyl)methylene]-2-(1-naphthylamino)-4-oxo-thiophene-3-carboxylate CAS Name: 5-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-(1-naphthalenylamino)-4-oxo-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-(naphthalen-1-ylamino)-4-oxothiophene-3-carboxylate Traditional Name: 4-keto-2-(1-naphthylamino)-5-vanillylidene-thiophene-3-carboxylic acid ethyl ester Formula: C25H21NO5S MolecularWeight: 447.50294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=CC2=CC(=C(C=C2)O)OC)C1=O)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C1=C(SC(=CC2=CC(=C(C=C2)O)OC)C1=O)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H21NO5S/c1-3-31-25(29)22-23(28)21(14-15-11-12-19(27)20(13-15)30-2)32-24(22)26-18-10-6-8-16-7-4-5-9-17(16)18/h4-14,26-27H,3H2,1-2H3