(2S,3S)-3-oxidanyl-2-[(1-phenylpyrazol-4-yl)carbonylamino]butanoate

Systemtic Name: (2S,3S)-3-oxidanyl-2-[(1-phenylpyrazol-4-yl)carbonylamino]butanoate Openeye Name: (2S,3S)-3-hydroxy-2-[(1-phenylpyrazole-4-carbonyl)amino]butanoate CAS Name: (2S,3S)-3-hydroxy-2-[[oxo-(1-phenyl-4-pyrazolyl)methyl]amino]butanoate IUPAC Name: (2S,3S)-3-hydroxy-2-[(1-phenylpyrazole-4-carbonyl)amino]butanoate Traditional Name: (2S,3S)-3-hydroxy-2-[(1-phenylpyrazole-4-carbonyl)amino]butyrate Formula: C14H14N3O4- MolecularWeight: 288.27866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3O4/c1-9(18)12(14(20)21)16-13(19)10-7-15-17(8-10)11-5-3-2-4-6-11/h2-9,12,18H,1H3,(H,16,19)(H,20,21)/p-1/t9-,12-/m0/s1