(2S)-2-[[4-[2-(dimethylazaniumyl)ethoxy]phenyl]carbonylamino]propanoate

Systemtic Name: (2S)-2-[[4-[2-(dimethylazaniumyl)ethoxy]phenyl]carbonylamino]propanoate Openeye Name: (2S)-2-[[4-[2-(dimethylammonio)ethoxy]benzoyl]amino]propanoate CAS Name: (2S)-2-[[[4-[2-(dimethylammonio)ethoxy]phenyl]-oxomethyl]amino]propanoate IUPAC Name: (2S)-2-[[4-[2-(dimethylazaniumyl)ethoxy]benzoyl]amino]propanoate Traditional Name: (2S)-2-[[4-[2-(dimethylammonio)ethoxy]benzoyl]amino]propionate Formula: C14H20N2O4 MolecularWeight: 280.3196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O4/c1-10(14(18)19)15-13(17)11-4-6-12(7-5-11)20-9-8-16(2)3/h4-7,10H,8-9H2,1-3H3,(H,15,17)(H,18,19)/t10-/m0/s1