O1-(2-methylpropoxycarbonyl) O5-(phenylmethyl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanedioate

Systemtic Name: O1-(2-methylpropoxycarbonyl) O5-(phenylmethyl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanedioate Openeye Name: O5-benzyl O1-isobutoxycarbonyl (2S)-2-(tert-butoxycarbonylamino)pentanedioate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanedioic acid O1-[2-methylpropoxy(oxo)methyl] ester O5-(phenylmethyl) ester IUPAC Name: 5-O-benzyl 1-O-(2-methylpropoxycarbonyl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanedioate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)glutaric acid O5-benzyl ester O1-isobutoxycarbonyl ester Formula: C22H31NO8 MolecularWeight: 437.48344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)OC(=O)C(CCC(=O)OCC1=CC=CC=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)COC(=O)OC(=O)[C@H](CCC(=O)OCC1=CC=CC=C1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H31NO8/c1-15(2)13-29-21(27)30-19(25)17(23-20(26)31-22(3,4)5)11-12-18(24)28-14-16-9-7-6-8-10-16/h6-10,15,17H,11-14H2,1-5H3,(H,23,26)/t17-/m0/s1