[2-[(4-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl] 3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate

Systemtic Name: [2-[(4-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl] 3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate Openeye Name: [2-[(4-methoxyphenyl)methylamino]-2-oxo-ethyl] 3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate CAS Name: 3-[4-(cyanomethoxy)-3-methoxyphenyl]-2-propenoic acid [2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 3-[4-(cyanomethoxy)-3-methoxyphenyl]prop-2-enoate Traditional Name: 3-[4-(cyanomethoxy)-3-methoxy-phenyl]acrylic acid [2-keto-2-(p-anisylamino)ethyl] ester Formula: C22H22N2O6 MolecularWeight: 410.41988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)COC(=O)C=CC2=CC(=C(C=C2)OCC#N)OC

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)COC(=O)C=CC2=CC(=C(C=C2)OCC#N)OC

InChI

InChI=1S/C22H22N2O6/c1-27-18-7-3-17(4-8-18)14-24-21(25)15-30-22(26)10-6-16-5-9-19(29-12-11-23)20(13-16)28-2/h3-10,13H,12,14-15H2,1-2H3,(H,24,25)