ethyl 3-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]-2-cyano-3-oxidanylidene-propanoate

Systemtic Name: ethyl 3-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]-2-cyano-3-oxidanylidene-propanoate Openeye Name: ethyl 2-cyano-3-[4-(1,3-dioxoisoindolin-2-yl)phenyl]-3-oxo-propanoate CAS Name: 2-cyano-3-[4-(1,3-dioxo-2-isoindolyl)phenyl]-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 2-cyano-3-[4-(1,3-dioxoisoindol-2-yl)phenyl]-3-oxopropanoate Traditional Name: 2-cyano-3-keto-3-(4-phthalimidophenyl)propionic acid ethyl ester Formula: C20H14N2O5 MolecularWeight: 362.33556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C(=O)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCOC(=O)C(C#N)C(=O)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C20H14N2O5/c1-2-27-20(26)16(11-21)17(23)12-7-9-13(10-8-12)22-18(24)14-5-3-4-6-15(14)19(22)25/h3-10,16H,2H2,1H3