(2S)-2-azaniumyl-3-(1-ethyl-3-methyl-pyrazol-4-yl)propanoate

Systemtic Name: (2S)-2-azaniumyl-3-(1-ethyl-3-methyl-pyrazol-4-yl)propanoate Openeye Name: (2S)-2-azaniumyl-3-(1-ethyl-3-methyl-pyrazol-4-yl)propanoate CAS Name: (2S)-2-ammonio-3-(1-ethyl-3-methyl-4-pyrazolyl)propanoate IUPAC Name: (2S)-2-azaniumyl-3-(1-ethyl-3-methylpyrazol-4-yl)propanoate Traditional Name: (2S)-2-ammonio-3-(1-ethyl-3-methyl-pyrazol-4-yl)propionate Formula: C9H15N3O2 MolecularWeight: 197.2343

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)CC(C(=O)[O-])[NH3+]

Isomeric SMILES

CCN1C=C(C(=N1)C)C[C@@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C9H15N3O2/c1-3-12-5-7(6(2)11-12)4-8(10)9(13)14/h5,8H,3-4,10H2,1-2H3,(H,13,14)/t8-/m0/s1