[4-[(E)-2-cyano-3-morpholin-4-yl-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 3-(3-chlorophenyl)propanoate

Systemtic Name: [4-[(E)-2-cyano-3-morpholin-4-yl-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 3-(3-chlorophenyl)propanoate Openeye Name: [4-[(E)-2-cyano-3-morpholino-3-oxo-prop-1-enyl]-2-methoxy-phenyl] 3-(3-chlorophenyl)propanoate CAS Name: 3-(3-chlorophenyl)propanoic acid [4-[(E)-2-cyano-3-(4-morpholinyl)-3-oxoprop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-cyano-3-morpholin-4-yl-3-oxoprop-1-enyl]-2-methoxyphenyl] 3-(3-chlorophenyl)propanoate Traditional Name: 3-(3-chlorophenyl)propionic acid [4-[(E)-2-cyano-3-keto-3-morpholino-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C24H23ClN2O5 MolecularWeight: 454.90282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)N2CCOCC2)OC(=O)CCC3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)N2CCOCC2)OC(=O)CCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C24H23ClN2O5/c1-30-22-15-18(13-19(16-26)24(29)27-9-11-31-12-10-27)5-7-21(22)32-23(28)8-6-17-3-2-4-20(25)14-17/h2-5,7,13-15H,6,8-12H2,1H3/b19-13+