2-[2-(4-bromanyl-3,5-dimethyl-phenoxy)ethanoylamino]ethyl-diethyl-azanium chloride

Systemtic Name: 2-[2-(4-bromanyl-3,5-dimethyl-phenoxy)ethanoylamino]ethyl-diethyl-azanium chloride Openeye Name: 2-[[2-(4-bromo-3,5-dimethyl-phenoxy)acetyl]amino]ethyl-diethyl-ammonium chloride CAS Name: 2-[[2-(4-bromo-3,5-dimethylphenoxy)-1-oxoethyl]amino]ethyl-diethylammonium chloride IUPAC Name: 2-[[2-(4-bromo-3,5-dimethylphenoxy)acetyl]amino]ethyl-diethylazanium chloride Traditional Name: 2-[[2-(4-bromo-3,5-dimethyl-phenoxy)acetyl]amino]ethyl-diethyl-ammonium chloride Formula: C16H26BrClN2O2 MolecularWeight: 393.74684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)COC1=CC(=C(C(=C1)C)Br)C.[Cl-]

Isomeric SMILES

CC[NH+](CC)CCNC(=O)COC1=CC(=C(C(=C1)C)Br)C.[Cl-]

InChI

InChI=1S/C16H25BrN2O2.ClH/c1-5-19(6-2)8-7-18-15(20)11-21-14-9-12(3)16(17)13(4)10-14;/h9-10H,5-8,11H2,1-4H3,(H,18,20);1H