butyl (E)-2-cyano-3-[3-methoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)phenyl]prop-2-enoate

Systemtic Name: butyl (E)-2-cyano-3-[3-methoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)phenyl]prop-2-enoate Openeye Name: butyl (E)-2-cyano-3-[3-methoxy-4-(2-morpholino-2-oxo-ethoxy)phenyl]prop-2-enoate CAS Name: (E)-2-cyano-3-[3-methoxy-4-[2-(4-morpholinyl)-2-oxoethoxy]phenyl]-2-propenoic acid butyl ester IUPAC Name: butyl (E)-2-cyano-3-[3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[4-(2-keto-2-morpholino-ethoxy)-3-methoxy-phenyl]acrylic acid butyl ester Formula: C21H26N2O6 MolecularWeight: 402.44094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(=CC1=CC(=C(C=C1)OCC(=O)N2CCOCC2)OC)C#N

Isomeric SMILES

CCCCOC(=O)/C(=C/C1=CC(=C(C=C1)OCC(=O)N2CCOCC2)OC)/C#N

InChI

InChI=1S/C21H26N2O6/c1-3-4-9-28-21(25)17(14-22)12-16-5-6-18(19(13-16)26-2)29-15-20(24)23-7-10-27-11-8-23/h5-6,12-13H,3-4,7-11,15H2,1-2H3/b17-12+