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

Systemtic Name: [(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] (2S)-2-(2-phenoxyethanoylamino)propanoate Openeye Name: [(1R)-1-allophanoyl-2-methyl-propyl] (2S)-2-[(2-phenoxyacetyl)amino]propanoate CAS Name: (2S)-2-[(1-oxo-2-phenoxyethyl)amino]propanoic acid [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] (2S)-2-[(2-phenoxyacetyl)amino]propanoate Traditional Name: (2S)-2-[(2-phenoxyacetyl)amino]propionic acid [(1R)-1-allophanoyl-2-methyl-propyl] ester Formula: C17H23N3O6 MolecularWeight: 365.38102

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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/C17H23N3O6/c1-10(2)14(15(22)20-17(18)24)26-16(23)11(3)19-13(21)9-25-12-7-5-4-6-8-12/h4-8,10-11,14H,9H2,1-3H3,(H,19,21)(H3,18,20,22,24)/t11-,14+/m0/s1