(2S)-2-azaniumyl-3-(1-methyl-6-oxidanylidene-pyridin-3-yl)propanoate

Systemtic Name: (2S)-2-azaniumyl-3-(1-methyl-6-oxidanylidene-pyridin-3-yl)propanoate Openeye Name: (2S)-2-azaniumyl-3-(1-methyl-6-oxo-3-pyridyl)propanoate CAS Name: (2S)-2-ammonio-3-(1-methyl-6-oxo-3-pyridinyl)propanoate IUPAC Name: (2S)-2-azaniumyl-3-(1-methyl-6-oxopyridin-3-yl)propanoate Traditional Name: (2S)-2-ammonio-3-(6-keto-1-methyl-3-pyridyl)propionate Formula: C9H12N2O3 MolecularWeight: 196.20318

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=CC1=O)CC(C(=O)[O-])[NH3+]

Isomeric SMILES

CN1C=C(C=CC1=O)C[C@@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C9H12N2O3/c1-11-5-6(2-3-8(11)12)4-7(10)9(13)14/h2-3,5,7H,4,10H2,1H3,(H,13,14)/t7-/m0/s1