3-[[butyl(methyl)azaniumyl]methoxy]benzoate

Systemtic Name: 3-[[butyl(methyl)azaniumyl]methoxy]benzoate Openeye Name: 3-[[butyl(methyl)ammonio]methoxy]benzoate CAS Name: 3-[[butyl(methyl)ammonio]methoxy]benzoate IUPAC Name: 3-[[butyl(methyl)azaniumyl]methoxy]benzoate Traditional Name: 3-[[butyl(methyl)ammonio]methoxy]benzoate Formula: C13H19NO3 MolecularWeight: 237.29486

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)COC1=CC=CC(=C1)C(=O)[O-]

Isomeric SMILES

CCCC[NH+](C)COC1=CC=CC(=C1)C(=O)[O-]

InChI

InChI=1S/C13H19NO3/c1-3-4-8-14(2)10-17-12-7-5-6-11(9-12)13(15)16/h5-7,9H,3-4,8,10H2,1-2H3,(H,15,16)