tert-butyl 3-cyano-3-phenyl-3-[phenylmethoxycarbonyl(phenylmethoxycarbonylamino)amino]propanoate

Systemtic Name: tert-butyl 3-cyano-3-phenyl-3-[phenylmethoxycarbonyl(phenylmethoxycarbonylamino)amino]propanoate Openeye Name: tert-butyl 3-[benzyloxycarbonyl(benzyloxycarbonylamino)amino]-3-cyano-3-phenyl-propanoate CAS Name: 3-cyano-3-phenyl-3-[phenylmethoxycarbonyl(phenylmethoxycarbonylamino)amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-cyano-3-phenyl-3-[phenylmethoxycarbonyl(phenylmethoxycarbonylamino)amino]propanoate Traditional Name: 3-[benzyloxycarbonylamino(carbobenzoxy)amino]-3-cyano-3-phenyl-propionic acid tert-butyl ester Formula: C30H31N3O6 MolecularWeight: 529.58364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(C#N)(C1=CC=CC=C1)N(C(=O)OCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)CC(C#N)(C1=CC=CC=C1)N(C(=O)OCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C30H31N3O6/c1-29(2,3)39-26(34)19-30(22-31,25-17-11-6-12-18-25)33(28(36)38-21-24-15-9-5-10-16-24)32-27(35)37-20-23-13-7-4-8-14-23/h4-18H,19-21H2,1-3H3,(H,32,35)