O5-tert-butyl O1-hexyl (2S)-2-(phenylmethoxycarbonylamino)pentanedioate

Systemtic Name: O5-tert-butyl O1-hexyl (2S)-2-(phenylmethoxycarbonylamino)pentanedioate Openeye Name: O5-tert-butyl O1-hexyl (2S)-2-(benzyloxycarbonylamino)pentanedioate CAS Name: (2S)-2-(phenylmethoxycarbonylamino)pentanedioic acid O5-tert-butyl ester O1-hexyl ester IUPAC Name: 5-O-tert-butyl 1-O-hexyl (2S)-2-(phenylmethoxycarbonylamino)pentanedioate Traditional Name: (2S)-2-(benzyloxycarbonylamino)glutaric acid O5-tert-butyl ester O1-hexyl ester Formula: C23H35NO6 MolecularWeight: 421.5271

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H35NO6/c1-5-6-7-11-16-28-21(26)19(14-15-20(25)30-23(2,3)4)24-22(27)29-17-18-12-9-8-10-13-18/h8-10,12-13,19H,5-7,11,14-17H2,1-4H3,(H,24,27)/t19-/m0/s1