(2S)-2-[(1-methylpyrazol-4-yl)carbonylamino]-2-phenyl-ethanoate

Systemtic Name: (2S)-2-[(1-methylpyrazol-4-yl)carbonylamino]-2-phenyl-ethanoate Openeye Name: (2S)-2-[(1-methylpyrazole-4-carbonyl)amino]-2-phenyl-acetate CAS Name: (2S)-2-[[(1-methyl-4-pyrazolyl)-oxomethyl]amino]-2-phenylacetate IUPAC Name: (2S)-2-[(1-methylpyrazole-4-carbonyl)amino]-2-phenylacetate Traditional Name: (2S)-2-[(1-methylpyrazole-4-carbonyl)amino]-2-phenyl-acetate Formula: C13H12N3O3- MolecularWeight: 258.25268

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(=O)NC(C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CN1C=C(C=N1)C(=O)N[C@@H](C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C13H13N3O3/c1-16-8-10(7-14-16)12(17)15-11(13(18)19)9-5-3-2-4-6-9/h2-8,11H,1H3,(H,15,17)(H,18,19)/p-1/t11-/m0/s1