(2-methylphenyl)methyl (2R)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-butanoate

Systemtic Name: (2-methylphenyl)methyl (2R)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-butanoate Openeye Name: o-tolylmethyl (2R)-2-(1,3-dioxoisoindolin-2-yl)-3-methyl-butanoate CAS Name: (2R)-2-(1,3-dioxo-2-isoindolyl)-3-methylbutanoic acid (2-methylphenyl)methyl ester IUPAC Name: (2-methylphenyl)methyl (2R)-2-(1,3-dioxoisoindol-2-yl)-3-methylbutanoate Traditional Name: (2R)-3-methyl-2-phthalimido-butyric acid (2-methylbenzyl) ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COC(=O)C(C(C)C)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC=CC=C1COC(=O)[C@@H](C(C)C)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H21NO4/c1-13(2)18(21(25)26-12-15-9-5-4-8-14(15)3)22-19(23)16-10-6-7-11-17(16)20(22)24/h4-11,13,18H,12H2,1-3H3/t18-/m1/s1