(2S)-2-azaniumyl-2-(1-methylpyrazol-4-yl)ethanoate

Systemtic Name: (2S)-2-azaniumyl-2-(1-methylpyrazol-4-yl)ethanoate Openeye Name: (2S)-2-azaniumyl-2-(1-methylpyrazol-4-yl)acetate CAS Name: (2S)-2-ammonio-2-(1-methyl-4-pyrazolyl)acetate IUPAC Name: (2S)-2-azaniumyl-2-(1-methylpyrazol-4-yl)acetate Traditional Name: (2S)-2-ammonio-2-(1-methylpyrazol-4-yl)acetate Formula: C6H9N3O2 MolecularWeight: 155.15456

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(C(=O)[O-])[NH3+]

Isomeric SMILES

CN1C=C(C=N1)[C@@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C6H9N3O2/c1-9-3-4(2-8-9)5(7)6(10)11/h2-3,5H,7H2,1H3,(H,10,11)/t5-/m0/s1