3-[2-[methyl-(phenylmethyl)azaniumyl]ethoxy]benzoate

Systemtic Name: 3-[2-[methyl-(phenylmethyl)azaniumyl]ethoxy]benzoate Openeye Name: 3-[2-[benzyl(methyl)ammonio]ethoxy]benzoate CAS Name: 3-[2-[methyl-(phenylmethyl)ammonio]ethoxy]benzoate IUPAC Name: 3-[2-[benzyl(methyl)azaniumyl]ethoxy]benzoate Traditional Name: 3-[2-[benzyl(methyl)ammonio]ethoxy]benzoate Formula: C17H19NO3 MolecularWeight: 285.33766

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCOC1=CC=CC(=C1)C(=O)[O-])CC2=CC=CC=C2

Isomeric SMILES

C[NH+](CCOC1=CC=CC(=C1)C(=O)[O-])CC2=CC=CC=C2

InChI

InChI=1S/C17H19NO3/c1-18(13-14-6-3-2-4-7-14)10-11-21-16-9-5-8-15(12-16)17(19)20/h2-9,12H,10-11,13H2,1H3,(H,19,20)