2-[4-(4-bromanyl-2-chloranyl-phenoxy)butylazaniumyl]ethyl-dimethyl-azanium

Systemtic Name: 2-[4-(4-bromanyl-2-chloranyl-phenoxy)butylazaniumyl]ethyl-dimethyl-azanium Openeye Name: 2-[4-(4-bromo-2-chloro-phenoxy)butylammonio]ethyl-dimethyl-ammonium CAS Name: 2-[4-(4-bromo-2-chlorophenoxy)butylammonio]ethyl-dimethylammonium IUPAC Name: 2-[4-(4-bromo-2-chlorophenoxy)butylazaniumyl]ethyl-dimethylazanium Traditional Name: 2-[4-(4-bromo-2-chloro-phenoxy)butylammonio]ethyl-dimethyl-ammonium Formula: C14H24BrClN2O+2 MolecularWeight: 351.71016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC[NH2+]CCCCOC1=C(C=C(C=C1)Br)Cl

Isomeric SMILES

C[NH+](C)CC[NH2+]CCCCOC1=C(C=C(C=C1)Br)Cl

InChI

InChI=1S/C14H22BrClN2O/c1-18(2)9-8-17-7-3-4-10-19-14-6-5-12(15)11-13(14)16/h5-6,11,17H,3-4,7-10H2,1-2H3/p+2