ethyl 4-(4-chlorophenyl)-5-cyano-2-methyl-6-oxidanyl-4H-pyran-3-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)-5-cyano-2-methyl-6-oxidanyl-4H-pyran-3-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-5-cyano-6-hydroxy-2-methyl-4H-pyran-3-carboxylate CAS Name: 4-(4-chlorophenyl)-5-cyano-6-hydroxy-2-methyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-5-cyano-6-hydroxy-2-methyl-4H-pyran-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-5-cyano-6-hydroxy-2-methyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C16H14ClNO4 MolecularWeight: 319.73966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)Cl)C#N)O)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)Cl)C#N)O)C

InChI

InChI=1S/C16H14ClNO4/c1-3-21-16(20)13-9(2)22-15(19)12(8-18)14(13)10-4-6-11(17)7-5-10/h4-7,14,19H,3H2,1-2H3