tert-butyl 2-[(2S)-3-phenyl-2-[[(2R)-2-phenylmethoxypropanoyl]amino]propanoyl]pyrazolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[(2S)-3-phenyl-2-[[(2R)-2-phenylmethoxypropanoyl]amino]propanoyl]pyrazolidine-1-carboxylate Openeye Name: tert-butyl 2-[(2S)-2-[[(2R)-2-benzyloxypropanoyl]amino]-3-phenyl-propanoyl]pyrazolidine-1-carboxylate CAS Name: 2-[(2S)-1-oxo-2-[[(2R)-1-oxo-2-phenylmethoxypropyl]amino]-3-phenylpropyl]-1-pyrazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(2S)-3-phenyl-2-[[(2R)-2-phenylmethoxypropanoyl]amino]propanoyl]pyrazolidine-1-carboxylate Traditional Name: 2-[(2S)-2-[[(2R)-2-benzoxypropanoyl]amino]-3-phenyl-propanoyl]pyrazolidine-1-carboxylic acid tert-butyl ester Formula: C27H35N3O5 MolecularWeight: 481.5839

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC1=CC=CC=C1)C(=O)N2CCCN2C(=O)OC(C)(C)C)OCC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N2CCCN2C(=O)OC(C)(C)C)OCC3=CC=CC=C3

InChI

InChI=1S/C27H35N3O5/c1-20(34-19-22-14-9-6-10-15-22)24(31)28-23(18-21-12-7-5-8-13-21)25(32)29-16-11-17-30(29)26(33)35-27(2,3)4/h5-10,12-15,20,23H,11,16-19H2,1-4H3,(H,28,31)/t20-,23+/m1/s1