(2S)-2-azanyl-3-[3-(4-methoxyphenyl)-5-oxidanylidene-2H-1,2-oxazol-4-yl]propanoic acid

Systemtic Name: (2S)-2-azanyl-3-[3-(4-methoxyphenyl)-5-oxidanylidene-2H-1,2-oxazol-4-yl]propanoic acid Openeye Name: (2S)-2-amino-3-[3-(4-methoxyphenyl)-5-oxo-2H-isoxazol-4-yl]propanoic acid CAS Name: (2S)-2-amino-3-[3-(4-methoxyphenyl)-5-oxo-2H-isoxazol-4-yl]propanoic acid IUPAC Name: (2S)-2-amino-3-[3-(4-methoxyphenyl)-5-oxo-2H-1,2-oxazol-4-yl]propanoic acid Traditional Name: (2S)-2-amino-3-[5-keto-3-(4-methoxyphenyl)-3-isoxazolin-4-yl]propionic acid Formula: C13H14N2O5 MolecularWeight: 278.26066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=O)ON2)CC(C(=O)O)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=O)ON2)C[C@@H](C(=O)O)N

InChI

InChI=1S/C13H14N2O5/c1-19-8-4-2-7(3-5-8)11-9(13(18)20-15-11)6-10(14)12(16)17/h2-5,10,15H,6,14H2,1H3,(H,16,17)/t10-/m0/s1