(2S)-2-(1,2-oxazol-5-ylcarbonylamino)-3-phenyl-propanoate

Systemtic Name: (2S)-2-(1,2-oxazol-5-ylcarbonylamino)-3-phenyl-propanoate Openeye Name: (2S)-2-(isoxazole-5-carbonylamino)-3-phenyl-propanoate CAS Name: (2S)-2-[[5-isoxazolyl(oxo)methyl]amino]-3-phenylpropanoate IUPAC Name: (2S)-2-(1,2-oxazole-5-carbonylamino)-3-phenylpropanoate Traditional Name: (2S)-2-(isoxazole-5-carbonylamino)-3-phenyl-propionate Formula: C13H11N2O4- MolecularWeight: 259.23744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)[O-])NC(=O)C2=CC=NO2

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)[O-])NC(=O)C2=CC=NO2

InChI

InChI=1S/C13H12N2O4/c16-12(11-6-7-14-19-11)15-10(13(17)18)8-9-4-2-1-3-5-9/h1-7,10H,8H2,(H,15,16)(H,17,18)/p-1/t10-/m0/s1