ditert-butyl (2S)-2-[[4-[2-(phenylmethoxycarbonylamino)ethanoylamino]phenyl]carbonylamino]pentanedioate

Systemtic Name: ditert-butyl (2S)-2-[[4-[2-(phenylmethoxycarbonylamino)ethanoylamino]phenyl]carbonylamino]pentanedioate Openeye Name: ditert-butyl (2S)-2-[[4-[[2-(benzyloxycarbonylamino)acetyl]amino]benzoyl]amino]pentanedioate CAS Name: (2S)-2-[[oxo-[4-[[1-oxo-2-(phenylmethoxycarbonylamino)ethyl]amino]phenyl]methyl]amino]pentanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl (2S)-2-[[4-[[2-(phenylmethoxycarbonylamino)acetyl]amino]benzoyl]amino]pentanedioate Traditional Name: (2S)-2-[[4-[[2-(benzyloxycarbonylamino)acetyl]amino]benzoyl]amino]glutaric acid ditert-butyl ester Formula: C30H39N3O8 MolecularWeight: 569.64596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC(C(=O)OC(C)(C)C)NC(=O)C1=CC=C(C=C1)NC(=O)CNC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)CC[C@@H](C(=O)OC(C)(C)C)NC(=O)C1=CC=C(C=C1)NC(=O)CNC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C30H39N3O8/c1-29(2,3)40-25(35)17-16-23(27(37)41-30(4,5)6)33-26(36)21-12-14-22(15-13-21)32-24(34)18-31-28(38)39-19-20-10-8-7-9-11-20/h7-15,23H,16-19H2,1-6H3,(H,31,38)(H,32,34)(H,33,36)/t23-/m0/s1