tert-butyl (2S)-2-[(3S)-2-oxidanylidene-3-(phenylmethoxycarbonylamino)pyrrolidin-1-yl]propanoate

Systemtic Name: tert-butyl (2S)-2-[(3S)-2-oxidanylidene-3-(phenylmethoxycarbonylamino)pyrrolidin-1-yl]propanoate Openeye Name: tert-butyl (2S)-2-[(3S)-3-(benzyloxycarbonylamino)-2-oxo-pyrrolidin-1-yl]propanoate CAS Name: (2S)-2-[(3S)-2-oxo-3-(phenylmethoxycarbonylamino)-1-pyrrolidinyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[(3S)-2-oxo-3-(phenylmethoxycarbonylamino)pyrrolidin-1-yl]propanoate Traditional Name: (2S)-2-[(3S)-3-(benzyloxycarbonylamino)-2-keto-pyrrolidino]propionic acid tert-butyl ester Formula: C19H26N2O5 MolecularWeight: 362.42014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C)(C)C)N1CCC(C1=O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)OC(C)(C)C)N1CC[C@@H](C1=O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H26N2O5/c1-13(17(23)26-19(2,3)4)21-11-10-15(16(21)22)20-18(24)25-12-14-8-6-5-7-9-14/h5-9,13,15H,10-12H2,1-4H3,(H,20,24)/t13-,15-/m0/s1