tert-butyl 4-[2-[phenyl(phenylmethoxycarbonyl)amino]ethanoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[phenyl(phenylmethoxycarbonyl)amino]ethanoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-(N-benzyloxycarbonylanilino)acetyl]piperazine-1-carboxylate CAS Name: 4-[1-oxo-2-(N-phenylmethoxycarbonylanilino)ethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(N-phenylmethoxycarbonylanilino)acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(N-carbobenzoxyanilino)acetyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C25H31N3O5 MolecularWeight: 453.53074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31N3O5/c1-25(2,3)33-23(30)27-16-14-26(15-17-27)22(29)18-28(21-12-8-5-9-13-21)24(31)32-19-20-10-6-4-7-11-20/h4-13H,14-19H2,1-3H3