tert-butyl (2S)-4-azanyl-4-oxidanylidene-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: tert-butyl (2S)-4-azanyl-4-oxidanylidene-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: tert-butyl (2S)-4-amino-2-(benzyloxycarbonylamino)-4-oxo-butanoate CAS Name: (2S)-4-amino-4-oxo-2-(phenylmethoxycarbonylamino)butanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-4-amino-4-oxo-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: (2S)-4-amino-2-(benzyloxycarbonylamino)-4-keto-butyric acid tert-butyl ester Formula: C16H22N2O5 MolecularWeight: 322.35628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC(=O)N)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CC(=O)N)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C16H22N2O5/c1-16(2,3)23-14(20)12(9-13(17)19)18-15(21)22-10-11-7-5-4-6-8-11/h4-8,12H,9-10H2,1-3H3,(H2,17,19)(H,18,21)/t12-/m0/s1