(2S)-2-[4-[4-[(dimethylazaniumyl)methyl]phenyl]phenyl]-2-oxidanyl-ethanoate

Systemtic Name: (2S)-2-[4-[4-[(dimethylazaniumyl)methyl]phenyl]phenyl]-2-oxidanyl-ethanoate Openeye Name: (2S)-2-[4-[4-[(dimethylammonio)methyl]phenyl]phenyl]-2-hydroxy-acetate CAS Name: (2S)-2-[4-[4-[(dimethylammonio)methyl]phenyl]phenyl]-2-hydroxyacetate IUPAC Name: (2S)-2-[4-[4-[(dimethylazaniumyl)methyl]phenyl]phenyl]-2-hydroxyacetate Traditional Name: (2S)-2-[4-[4-[(dimethylammonio)methyl]phenyl]phenyl]-2-hydroxy-acetate Formula: C17H19NO3 MolecularWeight: 285.33766

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=C(C=C1)C2=CC=C(C=C2)C(C(=O)[O-])O

Isomeric SMILES

C[NH+](C)CC1=CC=C(C=C1)C2=CC=C(C=C2)[C@@H](C(=O)[O-])O

InChI

InChI=1S/C17H19NO3/c1-18(2)11-12-3-5-13(6-4-12)14-7-9-15(10-8-14)16(19)17(20)21/h3-10,16,19H,11H2,1-2H3,(H,20,21)/t16-/m0/s1