[1,3-bis(oxidanylidene)isoindol-2-yl]methyl (2S)-2-[(4-tert-butylphenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl (2S)-2-[(4-tert-butylphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl (2S)-2-[(4-tert-butylbenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(4-tert-butylphenyl)-oxomethyl]amino]-3-methylbutanoic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl (2S)-2-[(4-tert-butylbenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(4-tert-butylbenzoyl)amino]-3-methyl-butyric acid phthalimidomethyl ester Formula: C25H28N2O5 MolecularWeight: 436.50022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCN1C(=O)C2=CC=CC=C2C1=O)NC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC(C)[C@@H](C(=O)OCN1C(=O)C2=CC=CC=C2C1=O)NC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C25H28N2O5/c1-15(2)20(26-21(28)16-10-12-17(13-11-16)25(3,4)5)24(31)32-14-27-22(29)18-8-6-7-9-19(18)23(27)30/h6-13,15,20H,14H2,1-5H3,(H,26,28)/t20-/m0/s1