[(2S)-1-(tert-butylcarbamoylamino)-1-oxidanylidene-propan-2-yl] (2S)-2-(2-phenoxyethanoylamino)propanoate

Systemtic Name: [(2S)-1-(tert-butylcarbamoylamino)-1-oxidanylidene-propan-2-yl] (2S)-2-(2-phenoxyethanoylamino)propanoate Openeye Name: [(1S)-2-(tert-butylcarbamoylamino)-1-methyl-2-oxo-ethyl] (2S)-2-[(2-phenoxyacetyl)amino]propanoate CAS Name: (2S)-2-[(1-oxo-2-phenoxyethyl)amino]propanoic acid [(2S)-1-[[(tert-butylamino)-oxomethyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(tert-butylcarbamoylamino)-1-oxopropan-2-yl] (2S)-2-[(2-phenoxyacetyl)amino]propanoate Traditional Name: (2S)-2-[(2-phenoxyacetyl)amino]propionic acid [(1S)-2-(tert-butylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C19H27N3O6 MolecularWeight: 393.43418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C)C(=O)NC(=O)NC(C)(C)C)NC(=O)COC1=CC=CC=C1

Isomeric SMILES

C[C@@H](C(=O)O[C@@H](C)C(=O)NC(=O)NC(C)(C)C)NC(=O)COC1=CC=CC=C1

InChI

InChI=1S/C19H27N3O6/c1-12(20-15(23)11-27-14-9-7-6-8-10-14)17(25)28-13(2)16(24)21-18(26)22-19(3,4)5/h6-10,12-13H,11H2,1-5H3,(H,20,23)(H2,21,22,24,26)/t12-,13-/m0/s1