3-[2-(dibutylazaniumyl)ethoxy]benzoate

Systemtic Name: 3-[2-(dibutylazaniumyl)ethoxy]benzoate Openeye Name: 3-[2-(dibutylammonio)ethoxy]benzoate CAS Name: 3-[2-(dibutylammonio)ethoxy]benzoate IUPAC Name: 3-[2-(dibutylazaniumyl)ethoxy]benzoate Traditional Name: 3-[2-(dibutylammonio)ethoxy]benzoate Formula: C17H27NO3 MolecularWeight: 293.40118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27NO3/c1-3-5-10-18(11-6-4-2)12-13-21-16-9-7-8-15(14-16)17(19)20/h7-9,14H,3-6,10-13H2,1-2H3,(H,19,20)