(2S)-2-(4-dimethylaminophenyl)-2-(dimethylazaniumyl)ethanoate

Systemtic Name: (2S)-2-(4-dimethylaminophenyl)-2-(dimethylazaniumyl)ethanoate Openeye Name: (2S)-2-(4-dimethylaminophenyl)-2-(dimethylammonio)acetate CAS Name: (2S)-2-(4-dimethylaminophenyl)-2-(dimethylammonio)acetate IUPAC Name: (2S)-2-(4-dimethylaminophenyl)-2-(dimethylazaniumyl)acetate Traditional Name: (2S)-2-(4-dimethylaminophenyl)-2-(dimethylammonio)acetate Formula: C12H18N2O2 MolecularWeight: 222.28352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O2/c1-13(2)10-7-5-9(6-8-10)11(12(15)16)14(3)4/h5-8,11H,1-4H3,(H,15,16)/t11-/m0/s1