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

Systemtic Name: (2S)-2-[3-[2-(dimethylazaniumyl)ethylcarbamoyl]phenoxy]propanoate Openeye Name: (2S)-2-[3-[2-(dimethylammonio)ethylcarbamoyl]phenoxy]propanoate CAS Name: (2S)-2-[3-[[2-(dimethylammonio)ethylamino]-oxomethyl]phenoxy]propanoate IUPAC Name: (2S)-2-[3-[2-(dimethylazaniumyl)ethylcarbamoyl]phenoxy]propanoate Traditional Name: (2S)-2-[3-[2-(dimethylammonio)ethylcarbamoyl]phenoxy]propionate Formula: C14H20N2O4 MolecularWeight: 280.3196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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