methyl (2S)-3-oxidanyl-2-[(3-phenyl-1H-pyrazol-5-yl)carbonylamino]propanoate

Systemtic Name: methyl (2S)-3-oxidanyl-2-[(3-phenyl-1H-pyrazol-5-yl)carbonylamino]propanoate Openeye Name: methyl (2S)-3-hydroxy-2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propanoate CAS Name: (2S)-3-hydroxy-2-[[oxo-(3-phenyl-1H-pyrazol-5-yl)methyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-hydroxy-2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propanoate Traditional Name: (2S)-3-hydroxy-2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propionic acid methyl ester Formula: C14H15N3O4 MolecularWeight: 289.2866

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)C1=CC(=NN1)C2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@H](CO)NC(=O)C1=CC(=NN1)C2=CC=CC=C2

InChI

InChI=1S/C14H15N3O4/c1-21-14(20)12(8-18)15-13(19)11-7-10(16-17-11)9-5-3-2-4-6-9/h2-7,12,18H,8H2,1H3,(H,15,19)(H,16,17)/t12-/m0/s1