dibutyl-(4-ethoxy-4-oxidanylidene-1-phenyl-butan-2-yl)azanium chloride

Systemtic Name: dibutyl-(4-ethoxy-4-oxidanylidene-1-phenyl-butan-2-yl)azanium chloride Openeye Name: (1-benzyl-3-ethoxy-3-oxo-propyl)-dibutyl-ammonium chloride CAS Name: dibutyl-(4-ethoxy-4-oxo-1-phenylbutan-2-yl)ammonium chloride IUPAC Name: dibutyl-(4-ethoxy-4-oxo-1-phenylbutan-2-yl)azanium chloride Traditional Name: (1-benzyl-3-ethoxy-3-keto-propyl)-dibutyl-ammonium chloride Formula: C20H34ClNO2 MolecularWeight: 355.94246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)C(CC1=CC=CC=C1)CC(=O)OCC.[Cl-]

Isomeric SMILES

CCCC[NH+](CCCC)C(CC1=CC=CC=C1)CC(=O)OCC.[Cl-]

InChI

InChI=1S/C20H33NO2.ClH/c1-4-7-14-21(15-8-5-2)19(17-20(22)23-6-3)16-18-12-10-9-11-13-18;/h9-13,19H,4-8,14-17H2,1-3H3;1H