3-[2-(trimethylazaniumyl)ethoxy]benzoate

Systemtic Name: 3-[2-(trimethylazaniumyl)ethoxy]benzoate Openeye Name: 3-[2-(trimethylammonio)ethoxy]benzoate CAS Name: 3-[2-(trimethylammonio)ethoxy]benzoate IUPAC Name: 3-[2-(trimethylazaniumyl)ethoxy]benzoate Traditional Name: 3-[2-(trimethylammonio)ethoxy]benzoate Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCOC1=CC=CC(=C1)C(=O)[O-]

Isomeric SMILES

C[N+](C)(C)CCOC1=CC=CC(=C1)C(=O)[O-]

InChI

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