3-oxidanyl-2-[(3-oxidanylidene-3-phenyl-propyl)azaniumyl]propanoate

Systemtic Name: 3-oxidanyl-2-[(3-oxidanylidene-3-phenyl-propyl)azaniumyl]propanoate Openeye Name: 3-hydroxy-2-[(3-oxo-3-phenyl-propyl)ammonio]propanoate CAS Name: 3-hydroxy-2-[(3-oxo-3-phenylpropyl)ammonio]propanoate IUPAC Name: 3-hydroxy-2-[(3-oxo-3-phenylpropyl)azaniumyl]propanoate Traditional Name: 3-hydroxy-2-[(3-keto-3-phenyl-propyl)ammonio]propionate Formula: C12H15NO4 MolecularWeight: 237.2518

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CC[NH2+]C(CO)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CC[NH2+]C(CO)C(=O)[O-]

InChI

InChI=1S/C12H15NO4/c14-8-10(12(16)17)13-7-6-11(15)9-4-2-1-3-5-9/h1-5,10,13-14H,6-8H2,(H,16,17)