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

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl (2S)-2-(benzyloxycarbonylamino)-3-methyl-butanoate CAS Name: (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-methyl-butyric acid phthalimidomethyl ester Formula: C22H22N2O6 MolecularWeight: 410.41988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCN1C(=O)C2=CC=CC=C2C1=O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)OCN1C(=O)C2=CC=CC=C2C1=O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H22N2O6/c1-14(2)18(23-22(28)29-12-15-8-4-3-5-9-15)21(27)30-13-24-19(25)16-10-6-7-11-17(16)20(24)26/h3-11,14,18H,12-13H2,1-2H3,(H,23,28)/t18-/m0/s1