(2S)-3-methyl-2-[(3-propanoyl-1,2-oxazol-5-yl)methoxycarbonylamino]butanoic acid

Systemtic Name: (2S)-3-methyl-2-[(3-propanoyl-1,2-oxazol-5-yl)methoxycarbonylamino]butanoic acid Openeye Name: (2S)-3-methyl-2-[(3-propanoylisoxazol-5-yl)methoxycarbonylamino]butanoic acid CAS Name: (2S)-3-methyl-2-[[oxo-[[3-(1-oxopropyl)-5-isoxazolyl]methoxy]methyl]amino]butanoic acid IUPAC Name: (2S)-3-methyl-2-[(3-propanoyl-1,2-oxazol-5-yl)methoxycarbonylamino]butanoic acid Traditional Name: (2S)-3-methyl-2-[(3-propionylisoxazol-5-yl)methoxycarbonylamino]butyric acid Formula: C13H18N2O6 MolecularWeight: 298.29182

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=NOC(=C1)COC(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CCC(=O)C1=NOC(=C1)COC(=O)N[C@@H](C(C)C)C(=O)O

InChI

InChI=1S/C13H18N2O6/c1-4-10(16)9-5-8(21-15-9)6-20-13(19)14-11(7(2)3)12(17)18/h5,7,11H,4,6H2,1-3H3,(H,14,19)(H,17,18)/t11-/m0/s1