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

Systemtic Name: tert-butyl 4-[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(2S)-2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]piperazine-1-carboxylate CAS Name: 4-[(2S)-1-oxo-3-phenyl-2-(phenylmethoxycarbonylamino)propyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]piperazine-1-carboxylate Traditional Name: 4-[(2S)-2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C26H33N3O5 MolecularWeight: 467.55732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H33N3O5/c1-26(2,3)34-25(32)29-16-14-28(15-17-29)23(30)22(18-20-10-6-4-7-11-20)27-24(31)33-19-21-12-8-5-9-13-21/h4-13,22H,14-19H2,1-3H3,(H,27,31)/t22-/m0/s1