(2S)-2-(azaniumylmethyl)-3-pyridin-4-yl-propanoate

Systemtic Name: (2S)-2-(azaniumylmethyl)-3-pyridin-4-yl-propanoate Openeye Name: (2S)-2-(azaniumylmethyl)-3-(4-pyridyl)propanoate CAS Name: (2S)-2-(ammoniomethyl)-3-pyridin-4-ylpropanoate IUPAC Name: (2S)-2-(azaniumylmethyl)-3-pyridin-4-ylpropanoate Traditional Name: (2S)-2-(ammoniomethyl)-3-(4-pyridyl)propionate Formula: C9H12N2O2 MolecularWeight: 180.20378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1CC(C[NH3+])C(=O)[O-]

Isomeric SMILES

C1=CN=CC=C1C[C@@H](C[NH3+])C(=O)[O-]

InChI

InChI=1S/C9H12N2O2/c10-6-8(9(12)13)5-7-1-3-11-4-2-7/h1-4,8H,5-6,10H2,(H,12,13)/t8-/m0/s1