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

Systemtic Name: (2-tert-butyl-4-methyl-phenyl) 3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate Openeye Name: (2-tert-butyl-4-methyl-phenyl) 3-(1,3-dioxoisoindolin-2-yl)propanoate CAS Name: 3-(1,3-dioxo-2-isoindolyl)propanoic acid (2-tert-butyl-4-methylphenyl) ester IUPAC Name: (2-tert-butyl-4-methylphenyl) 3-(1,3-dioxoisoindol-2-yl)propanoate Traditional Name: 3-phthalimidopropionic acid (2-tert-butyl-4-methyl-phenyl) ester Formula: C22H23NO4 MolecularWeight: 365.42232

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23NO4/c1-14-9-10-18(17(13-14)22(2,3)4)27-19(24)11-12-23-20(25)15-7-5-6-8-16(15)21(23)26/h5-10,13H,11-12H2,1-4H3