(2S)-2-azaniumyl-3-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)propanoate

Systemtic Name: (2S)-2-azaniumyl-3-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)propanoate Openeye Name: (2S)-2-azaniumyl-3-(6-methyl-4-oxo-1H-pyrimidin-2-yl)propanoate CAS Name: (2S)-2-ammonio-3-(6-methyl-4-oxo-1H-pyrimidin-2-yl)propanoate IUPAC Name: (2S)-2-azaniumyl-3-(6-methyl-4-oxo-1H-pyrimidin-2-yl)propanoate Traditional Name: (2S)-2-ammonio-3-(4-keto-6-methyl-1H-pyrimidin-2-yl)propionate Formula: C8H11N3O3 MolecularWeight: 197.19124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H11N3O3/c1-4-2-7(12)11-6(10-4)3-5(9)8(13)14/h2,5H,3,9H2,1H3,(H,13,14)(H,10,11,12)/t5-/m0/s1