ethyl 4-(4-acetamidophenyl)-5-oxidanylidene-2-phenyl-4,6,7,8-tetrahydrochromene-3-carboxylate

Systemtic Name: ethyl 4-(4-acetamidophenyl)-5-oxidanylidene-2-phenyl-4,6,7,8-tetrahydrochromene-3-carboxylate Openeye Name: ethyl 4-(4-acetamidophenyl)-5-oxo-2-phenyl-4,6,7,8-tetrahydrochromene-3-carboxylate CAS Name: 4-(4-acetamidophenyl)-5-oxo-2-phenyl-4,6,7,8-tetrahydro-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-acetamidophenyl)-5-oxo-2-phenyl-4,6,7,8-tetrahydrochromene-3-carboxylate Traditional Name: 4-(4-acetamidophenyl)-5-keto-2-phenyl-4,6,7,8-tetrahydrochromene-3-carboxylic acid ethyl ester Formula: C26H25NO5 MolecularWeight: 431.4804

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C(C1C3=CC=C(C=C3)NC(=O)C)C(=O)CCC2)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(OC2=C(C1C3=CC=C(C=C3)NC(=O)C)C(=O)CCC2)C4=CC=CC=C4

InChI

InChI=1S/C26H25NO5/c1-3-31-26(30)24-22(17-12-14-19(15-13-17)27-16(2)28)23-20(29)10-7-11-21(23)32-25(24)18-8-5-4-6-9-18/h4-6,8-9,12-15,22H,3,7,10-11H2,1-2H3,(H,27,28)