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

Systemtic Name: [4-[(E)-2-cyano-3-morpholin-4-yl-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 2-(4-chloranyl-2-methyl-phenoxy)propanoate Openeye Name: [4-[(E)-2-cyano-3-morpholino-3-oxo-prop-1-enyl]-2-methoxy-phenyl] 2-(4-chloro-2-methyl-phenoxy)propanoate CAS Name: 2-(4-chloro-2-methylphenoxy)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] 2-(4-chloro-2-methylphenoxy)propanoate Traditional Name: 2-(4-chloro-2-methyl-phenoxy)propionic acid [4-[(E)-2-cyano-3-keto-3-morpholino-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C25H25ClN2O6 MolecularWeight: 484.9288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OC(C)C(=O)OC2=C(C=C(C=C2)C=C(C#N)C(=O)N3CCOCC3)OC

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OC(C)C(=O)OC2=C(C=C(C=C2)/C=C(\C#N)/C(=O)N3CCOCC3)OC

InChI

InChI=1S/C25H25ClN2O6/c1-16-12-20(26)5-7-21(16)33-17(2)25(30)34-22-6-4-18(14-23(22)31-3)13-19(15-27)24(29)28-8-10-32-11-9-28/h4-7,12-14,17H,8-11H2,1-3H3/b19-13+