tert-butyl (2S)-5-oxidanylidene-2-(phenylmethoxycarbonylamino)-5-[[(1R)-1-(2H-1,2,3,4-tetrazol-5-yl)ethyl]amino]pentanoate

Systemtic Name: tert-butyl (2S)-5-oxidanylidene-2-(phenylmethoxycarbonylamino)-5-[[(1R)-1-(2H-1,2,3,4-tetrazol-5-yl)ethyl]amino]pentanoate Openeye Name: tert-butyl (2S)-2-(benzyloxycarbonylamino)-5-oxo-5-[[(1R)-1-(2H-tetrazol-5-yl)ethyl]amino]pentanoate CAS Name: (2S)-5-oxo-2-(phenylmethoxycarbonylamino)-5-[[(1R)-1-(2H-tetrazol-5-yl)ethyl]amino]pentanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-5-oxo-2-(phenylmethoxycarbonylamino)-5-[[(1R)-1-(2H-tetrazol-5-yl)ethyl]amino]pentanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-5-keto-5-[[(1R)-1-(2H-tetrazol-5-yl)ethyl]amino]valeric acid tert-butyl ester Formula: C20H28N6O5 MolecularWeight: 432.47352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NNN=N1)NC(=O)CCC(C(=O)OC(C)(C)C)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C[C@H](C1=NNN=N1)NC(=O)CC[C@@H](C(=O)OC(C)(C)C)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H28N6O5/c1-13(17-23-25-26-24-17)21-16(27)11-10-15(18(28)31-20(2,3)4)22-19(29)30-12-14-8-6-5-7-9-14/h5-9,13,15H,10-12H2,1-4H3,(H,21,27)(H,22,29)(H,23,24,25,26)/t13-,15+/m1/s1