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

Systemtic Name: [2-(2,4-dimethylphenyl)-2-oxidanylidene-ethyl] 3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate Openeye Name: [2-(2,4-dimethylphenyl)-2-oxo-ethyl] 3-(1,3-dioxoisoindolin-2-yl)propanoate CAS Name: 3-(1,3-dioxo-2-isoindolyl)propanoic acid [2-(2,4-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dimethylphenyl)-2-oxoethyl] 3-(1,3-dioxoisoindol-2-yl)propanoate Traditional Name: 3-phthalimidopropionic acid [2-(2,4-dimethylphenyl)-2-keto-ethyl] ester Formula: C21H19NO5 MolecularWeight: 365.37926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)COC(=O)CCN2C(=O)C3=CC=CC=C3C2=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)COC(=O)CCN2C(=O)C3=CC=CC=C3C2=O)C

InChI

InChI=1S/C21H19NO5/c1-13-7-8-15(14(2)11-13)18(23)12-27-19(24)9-10-22-20(25)16-5-3-4-6-17(16)21(22)26/h3-8,11H,9-10,12H2,1-2H3