2-azaniumylethyl-[3-(4-bromanyl-2-chloranyl-phenoxy)propyl]azanium

Systemtic Name: 2-azaniumylethyl-[3-(4-bromanyl-2-chloranyl-phenoxy)propyl]azanium Openeye Name: 2-azaniumylethyl-[3-(4-bromo-2-chloro-phenoxy)propyl]ammonium CAS Name: 2-ammonioethyl-[3-(4-bromo-2-chlorophenoxy)propyl]ammonium IUPAC Name: 2-azaniumylethyl-[3-(4-bromo-2-chlorophenoxy)propyl]azanium Traditional Name: 2-ammonioethyl-[3-(4-bromo-2-chloro-phenoxy)propyl]ammonium Formula: C11H18BrClN2O+2 MolecularWeight: 309.63042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)Cl)OCCC[NH2+]CC[NH3+]

Isomeric SMILES

C1=CC(=C(C=C1Br)Cl)OCCC[NH2+]CC[NH3+]

InChI

InChI=1S/C11H16BrClN2O/c12-9-2-3-11(10(13)8-9)16-7-1-5-15-6-4-14/h2-3,8,15H,1,4-7,14H2/p+2