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

Systemtic Name: (2S)-3-oxidanyl-2-[(1-phenylpyrazol-4-yl)carbonylamino]propanoate Openeye Name: (2S)-3-hydroxy-2-[(1-phenylpyrazole-4-carbonyl)amino]propanoate CAS Name: (2S)-3-hydroxy-2-[[oxo-(1-phenyl-4-pyrazolyl)methyl]amino]propanoate IUPAC Name: (2S)-3-hydroxy-2-[(1-phenylpyrazole-4-carbonyl)amino]propanoate Traditional Name: (2S)-3-hydroxy-2-[(1-phenylpyrazole-4-carbonyl)amino]propionate Formula: C13H12N3O4- MolecularWeight: 274.25208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)C(=O)NC(CO)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)C(=O)N[C@@H](CO)C(=O)[O-]

InChI

InChI=1S/C13H13N3O4/c17-8-11(13(19)20)15-12(18)9-6-14-16(7-9)10-4-2-1-3-5-10/h1-7,11,17H,8H2,(H,15,18)(H,19,20)/p-1/t11-/m0/s1