(2S)-2-azaniumyl-2-(4,6-dimethylpyrimidin-2-yl)ethanoate

Systemtic Name: (2S)-2-azaniumyl-2-(4,6-dimethylpyrimidin-2-yl)ethanoate Openeye Name: (2S)-2-azaniumyl-2-(4,6-dimethylpyrimidin-2-yl)acetate CAS Name: (2S)-2-ammonio-2-(4,6-dimethyl-2-pyrimidinyl)acetate IUPAC Name: (2S)-2-azaniumyl-2-(4,6-dimethylpyrimidin-2-yl)acetate Traditional Name: (2S)-2-ammonio-2-(4,6-dimethylpyrimidin-2-yl)acetate Formula: C8H11N3O2 MolecularWeight: 181.19184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C(=O)[O-])[NH3+])C

Isomeric SMILES

CC1=CC(=NC(=N1)[C@@H](C(=O)[O-])[NH3+])C

InChI

InChI=1S/C8H11N3O2/c1-4-3-5(2)11-7(10-4)6(9)8(12)13/h3,6H,9H2,1-2H3,(H,12,13)/t6-/m0/s1