3-[[(2S)-2-azaniumyl-3-phenyl-propanoyl]amino]propanoate

Systemtic Name: 3-[[(2S)-2-azaniumyl-3-phenyl-propanoyl]amino]propanoate Openeye Name: 3-[[(2S)-2-azaniumyl-3-phenyl-propanoyl]amino]propanoate CAS Name: 3-[[(2S)-2-ammonio-1-oxo-3-phenylpropyl]amino]propanoate IUPAC Name: 3-[[(2S)-2-azaniumyl-3-phenylpropanoyl]amino]propanoate Traditional Name: 3-[[(2S)-2-ammonio-3-phenyl-propanoyl]amino]propionate Formula: C12H16N2O3 MolecularWeight: 236.26704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O3/c13-10(8-9-4-2-1-3-5-9)12(17)14-7-6-11(15)16/h1-5,10H,6-8,13H2,(H,14,17)(H,15,16)/t10-/m0/s1