2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[(1-oxo-2-phenylethyl)amino]butanoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(2-phenylacetyl)amino]butyric acid 2-phthalimidoethyl ester Formula: C23H24N2O5 MolecularWeight: 408.44706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCCN1C(=O)C2=CC=CC=C2C1=O)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)OCCN1C(=O)C2=CC=CC=C2C1=O)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C23H24N2O5/c1-15(2)20(24-19(26)14-16-8-4-3-5-9-16)23(29)30-13-12-25-21(27)17-10-6-7-11-18(17)22(25)28/h3-11,15,20H,12-14H2,1-2H3,(H,24,26)/t20-/m0/s1