tert-butyl (2S,3S)-3-(4-methylphenyl)-2-phenyl-3-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: tert-butyl (2S,3S)-3-(4-methylphenyl)-2-phenyl-3-(phenylmethoxycarbonylamino)propanoate Openeye Name: tert-butyl (2S,3S)-3-(benzyloxycarbonylamino)-2-phenyl-3-(p-tolyl)propanoate CAS Name: (2S,3S)-3-(4-methylphenyl)-2-phenyl-3-(phenylmethoxycarbonylamino)propanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3S)-3-(4-methylphenyl)-2-phenyl-3-(phenylmethoxycarbonylamino)propanoate Traditional Name: (2S,3S)-3-(benzyloxycarbonylamino)-2-phenyl-3-(p-tolyl)propionic acid tert-butyl ester Formula: C28H31NO4 MolecularWeight: 445.55004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(C2=CC=CC=C2)C(=O)OC(C)(C)C)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)[C@H]([C@H](C2=CC=CC=C2)C(=O)OC(C)(C)C)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C28H31NO4/c1-20-15-17-23(18-16-20)25(29-27(31)32-19-21-11-7-5-8-12-21)24(22-13-9-6-10-14-22)26(30)33-28(2,3)4/h5-18,24-25H,19H2,1-4H3,(H,29,31)/t24-,25+/m0/s1