2-azaniumylethyl-[2-[2-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)ethoxy]ethyl]azanium

Systemtic Name: 2-azaniumylethyl-[2-[2-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)ethoxy]ethyl]azanium Openeye Name: 2-azaniumylethyl-[2-[2-(2-bromo-6-chloro-4-methyl-phenoxy)ethoxy]ethyl]ammonium CAS Name: 2-ammonioethyl-[2-[2-(2-bromo-6-chloro-4-methylphenoxy)ethoxy]ethyl]ammonium IUPAC Name: 2-azaniumylethyl-[2-[2-(2-bromo-6-chloro-4-methylphenoxy)ethoxy]ethyl]azanium Traditional Name: 2-ammonioethyl-[2-[2-(2-bromo-6-chloro-4-methyl-phenoxy)ethoxy]ethyl]ammonium Formula: C13H22BrClN2O2+2 MolecularWeight: 353.68298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCCOCC[NH2+]CC[NH3+])Cl

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCCOCC[NH2+]CC[NH3+])Cl

InChI

InChI=1S/C13H20BrClN2O2/c1-10-8-11(14)13(12(15)9-10)19-7-6-18-5-4-17-3-2-16/h8-9,17H,2-7,16H2,1H3/p+2