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

Systemtic Name: (3-methyl-4-propan-2-yl-phenyl) 3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate Openeye Name: (4-isopropyl-3-methyl-phenyl) 3-(1,3-dioxoisoindolin-2-yl)propanoate CAS Name: 3-(1,3-dioxo-2-isoindolyl)propanoic acid (3-methyl-4-propan-2-ylphenyl) ester IUPAC Name: (3-methyl-4-propan-2-ylphenyl) 3-(1,3-dioxoisoindol-2-yl)propanoate Traditional Name: 3-phthalimidopropionic acid (4-isopropyl-3-methyl-phenyl) ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21NO4/c1-13(2)16-9-8-15(12-14(16)3)26-19(23)10-11-22-20(24)17-6-4-5-7-18(17)21(22)25/h4-9,12-13H,10-11H2,1-3H3