(4-nitrophenyl)methyl (2R)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methyl-pentanoate

Systemtic Name: (4-nitrophenyl)methyl (2R)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methyl-pentanoate Openeye Name: (4-nitrophenyl)methyl (2R)-2-(1,3-dioxoisoindolin-2-yl)-4-methyl-pentanoate CAS Name: (2R)-2-(1,3-dioxo-2-isoindolyl)-4-methylpentanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl (2R)-2-(1,3-dioxoisoindol-2-yl)-4-methylpentanoate Traditional Name: (2R)-4-methyl-2-phthalimido-valeric acid (4-nitrobenzyl) ester Formula: C21H20N2O6 MolecularWeight: 396.3933

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)C[C@H](C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H20N2O6/c1-13(2)11-18(22-19(24)16-5-3-4-6-17(16)20(22)25)21(26)29-12-14-7-9-15(10-8-14)23(27)28/h3-10,13,18H,11-12H2,1-2H3/t18-/m1/s1