(2S)-2-[3-[(dimethylazaniumyl)methyl]phenoxy]propanoate

Systemtic Name: (2S)-2-[3-[(dimethylazaniumyl)methyl]phenoxy]propanoate Openeye Name: (2S)-2-[3-[(dimethylammonio)methyl]phenoxy]propanoate CAS Name: (2S)-2-[3-[(dimethylammonio)methyl]phenoxy]propanoate IUPAC Name: (2S)-2-[3-[(dimethylazaniumyl)methyl]phenoxy]propanoate Traditional Name: (2S)-2-[3-[(dimethylammonio)methyl]phenoxy]propionate Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])OC1=CC=CC(=C1)C[NH+](C)C

Isomeric SMILES

C[C@@H](C(=O)[O-])OC1=CC=CC(=C1)C[NH+](C)C

InChI

InChI=1S/C12H17NO3/c1-9(12(14)15)16-11-6-4-5-10(7-11)8-13(2)3/h4-7,9H,8H2,1-3H3,(H,14,15)/t9-/m0/s1