3-[[bis(2-methylpropyl)azaniumyl]methoxy]benzoate

Systemtic Name: 3-[[bis(2-methylpropyl)azaniumyl]methoxy]benzoate Openeye Name: 3-[(diisobutylammonio)methoxy]benzoate CAS Name: 3-[[bis(2-methylpropyl)ammonio]methoxy]benzoate IUPAC Name: 3-[[bis(2-methylpropyl)azaniumyl]methoxy]benzoate Traditional Name: 3-[(diisobutylammonio)methoxy]benzoate Formula: C16H25NO3 MolecularWeight: 279.3746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25NO3/c1-12(2)9-17(10-13(3)4)11-20-15-7-5-6-14(8-15)16(18)19/h5-8,12-13H,9-11H2,1-4H3,(H,18,19)