(2S)-2-[methyl-(phenylmethyl)azaniumyl]-3-oxidanyl-propanoate

Systemtic Name: (2S)-2-[methyl-(phenylmethyl)azaniumyl]-3-oxidanyl-propanoate Openeye Name: (2S)-2-[benzyl(methyl)ammonio]-3-hydroxy-propanoate CAS Name: (2S)-3-hydroxy-2-[methyl-(phenylmethyl)ammonio]propanoate IUPAC Name: (2S)-2-[benzyl(methyl)azaniumyl]-3-hydroxypropanoate Traditional Name: (2S)-2-[benzyl(methyl)ammonio]-3-hydroxy-propionate Formula: C11H15NO3 MolecularWeight: 209.2417

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)C(CO)C(=O)[O-]

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)[C@@H](CO)C(=O)[O-]

InChI

InChI=1S/C11H15NO3/c1-12(10(8-13)11(14)15)7-9-5-3-2-4-6-9/h2-6,10,13H,7-8H2,1H3,(H,14,15)/t10-/m0/s1