tert-butyl 4-[(2S)-2-(phenylmethoxycarbonylamino)-3-(4-phenylmethoxycarbonyloxyphenyl)propanoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(2S)-2-(phenylmethoxycarbonylamino)-3-(4-phenylmethoxycarbonyloxyphenyl)propanoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(2S)-2-(benzyloxycarbonylamino)-3-(4-benzyloxycarbonyloxyphenyl)propanoyl]piperazine-1-carboxylate CAS Name: 4-[(2S)-1-oxo-2-(phenylmethoxycarbonylamino)-3-(4-phenylmethoxycarbonyloxyphenyl)propyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(2S)-2-(phenylmethoxycarbonylamino)-3-(4-phenylmethoxycarbonyloxyphenyl)propanoyl]piperazine-1-carboxylate Traditional Name: 4-[(2S)-2-(benzyloxycarbonylamino)-3-(4-carbobenzoxyoxyphenyl)propanoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C34H39N3O8 MolecularWeight: 617.68876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C(CC2=CC=C(C=C2)OC(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)[C@H](CC2=CC=C(C=C2)OC(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C34H39N3O8/c1-34(2,3)45-32(40)37-20-18-36(19-21-37)30(38)29(35-31(39)42-23-26-10-6-4-7-11-26)22-25-14-16-28(17-15-25)44-33(41)43-24-27-12-8-5-9-13-27/h4-17,29H,18-24H2,1-3H3,(H,35,39)/t29-/m0/s1