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

Systemtic Name: [(1R)-1-cyanoethyl] (2R)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-butanoate Openeye Name: [(1R)-1-cyanoethyl] (2R)-2-(1,3-dioxoisoindolin-2-yl)-3-methyl-butanoate CAS Name: (2R)-2-(1,3-dioxo-2-isoindolyl)-3-methylbutanoic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] (2R)-2-(1,3-dioxoisoindol-2-yl)-3-methylbutanoate Traditional Name: (2R)-3-methyl-2-phthalimido-butyric acid [(1R)-1-cyanoethyl] ester Formula: C16H16N2O4 MolecularWeight: 300.30924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C)C#N)N1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

C[C@H](C#N)OC(=O)[C@@H](C(C)C)N1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C16H16N2O4/c1-9(2)13(16(21)22-10(3)8-17)18-14(19)11-6-4-5-7-12(11)15(18)20/h4-7,9-10,13H,1-3H3/t10-,13-/m1/s1