[(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] (2S)-3-methyl-2-(2-phenoxyethanoylamino)butanoate

Systemtic Name: [(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] (2S)-3-methyl-2-(2-phenoxyethanoylamino)butanoate Openeye Name: [(1R)-1-allophanoyl-2-methyl-propyl] (2S)-3-methyl-2-[(2-phenoxyacetyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[(1-oxo-2-phenoxyethyl)amino]butanoic acid [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] (2S)-3-methyl-2-[(2-phenoxyacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(2-phenoxyacetyl)amino]butyric acid [(1R)-1-allophanoyl-2-methyl-propyl] ester Formula: C19H27N3O6 MolecularWeight: 393.43418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27N3O6/c1-11(2)15(21-14(23)10-27-13-8-6-5-7-9-13)18(25)28-16(12(3)4)17(24)22-19(20)26/h5-9,11-12,15-16H,10H2,1-4H3,(H,21,23)(H3,20,22,24,26)/t15-,16+/m0/s1