(2S)-3-oxidanyl-2-(3-phenylprop-2-ynoylamino)propanoate

Systemtic Name: (2S)-3-oxidanyl-2-(3-phenylprop-2-ynoylamino)propanoate Openeye Name: (2S)-3-hydroxy-2-(3-phenylprop-2-ynoylamino)propanoate CAS Name: (2S)-3-hydroxy-2-[(1-oxo-3-phenylprop-2-ynyl)amino]propanoate IUPAC Name: (2S)-3-hydroxy-2-(3-phenylprop-2-ynoylamino)propanoate Traditional Name: (2S)-3-hydroxy-2-[(3-phenylpropioloyl)amino]propionate Formula: C12H10NO4- MolecularWeight: 232.2121

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC(=O)NC(CO)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C#CC(=O)N[C@@H](CO)C(=O)[O-]

InChI

InChI=1S/C12H11NO4/c14-8-10(12(16)17)13-11(15)7-6-9-4-2-1-3-5-9/h1-5,10,14H,8H2,(H,13,15)(H,16,17)/p-1/t10-/m0/s1