[4-[(E)-2-cyano-3-[(4-ethanoylphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2,6-dimethoxy-phenyl] ethanoate

Systemtic Name: [4-[(E)-2-cyano-3-[(4-ethanoylphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2,6-dimethoxy-phenyl] ethanoate Openeye Name: [4-[(E)-3-(4-acetylanilino)-2-cyano-3-oxo-prop-1-enyl]-2,6-dimethoxy-phenyl] acetate CAS Name: acetic acid [4-[(E)-3-(4-acetylanilino)-2-cyano-3-oxoprop-1-enyl]-2,6-dimethoxyphenyl] ester IUPAC Name: [4-[(E)-3-(4-acetylanilino)-2-cyano-3-oxoprop-1-enyl]-2,6-dimethoxyphenyl] acetate Traditional Name: acetic acid [4-[(E)-3-(4-acetylanilino)-2-cyano-3-keto-prop-1-enyl]-2,6-dimethoxy-phenyl] ester Formula: C22H20N2O6 MolecularWeight: 408.404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C(=C2)OC)OC(=O)C)OC)C#N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)/C(=C/C2=CC(=C(C(=C2)OC)OC(=O)C)OC)/C#N

InChI

InChI=1S/C22H20N2O6/c1-13(25)16-5-7-18(8-6-16)24-22(27)17(12-23)9-15-10-19(28-3)21(30-14(2)26)20(11-15)29-4/h5-11H,1-4H3,(H,24,27)/b17-9+