(2-tert-butyl-4-methyl-phenyl) 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoate

Systemtic Name: (2-tert-butyl-4-methyl-phenyl) 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoate Openeye Name: (2-tert-butyl-4-methyl-phenyl) 2-(1,3-dioxoisoindolin-2-yl)acetate CAS Name: 2-(1,3-dioxo-2-isoindolyl)acetic acid (2-tert-butyl-4-methylphenyl) ester IUPAC Name: (2-tert-butyl-4-methylphenyl) 2-(1,3-dioxoisoindol-2-yl)acetate Traditional Name: 2-phthalimidoacetic acid (2-tert-butyl-4-methyl-phenyl) ester Formula: C21H21NO4 MolecularWeight: 351.39574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)CN2C(=O)C3=CC=CC=C3C2=O)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)CN2C(=O)C3=CC=CC=C3C2=O)C(C)(C)C

InChI

InChI=1S/C21H21NO4/c1-13-9-10-17(16(11-13)21(2,3)4)26-18(23)12-22-19(24)14-7-5-6-8-15(14)20(22)25/h5-11H,12H2,1-4H3