2-[4-azanyl-2,6-bis(bromanyl)phenoxy]ethyl-dimethyl-(2-methylprop-2-enyl)azanium chloride

Systemtic Name: 2-[4-azanyl-2,6-bis(bromanyl)phenoxy]ethyl-dimethyl-(2-methylprop-2-enyl)azanium chloride Openeye Name: 2-(4-amino-2,6-dibromo-phenoxy)ethyl-dimethyl-(2-methylallyl)ammonium chloride CAS Name: 2-(4-amino-2,6-dibromophenoxy)ethyl-dimethyl-(2-methylprop-2-enyl)ammonium chloride IUPAC Name: 2-(4-amino-2,6-dibromophenoxy)ethyl-dimethyl-(2-methylprop-2-enyl)azanium chloride Traditional Name: 2-(4-amino-2,6-dibromo-phenoxy)ethyl-dimethyl-(2-methylallyl)ammonium chloride Formula: C14H21Br2ClN2O MolecularWeight: 428.59034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C[N+](C)(C)CCOC1=C(C=C(C=C1Br)N)Br.[Cl-]

Isomeric SMILES

CC(=C)C[N+](C)(C)CCOC1=C(C=C(C=C1Br)N)Br.[Cl-]

InChI

InChI=1S/C14H21Br2N2O.ClH/c1-10(2)9-18(3,4)5-6-19-14-12(15)7-11(17)8-13(14)16;/h7-8H,1,5-6,9,17H2,2-4H3;1H/q+1;/p-1