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

Systemtic Name: 2-[2-(4-bromanyl-2-chloranyl-phenoxy)ethylamino]ethyl-dimethyl-azanium Openeye Name: 2-[2-(4-bromo-2-chloro-phenoxy)ethylamino]ethyl-dimethyl-ammonium CAS Name: 2-[2-(4-bromo-2-chlorophenoxy)ethylamino]ethyl-dimethylammonium IUPAC Name: 2-[2-(4-bromo-2-chlorophenoxy)ethylamino]ethyl-dimethylazanium Traditional Name: 2-[2-(4-bromo-2-chloro-phenoxy)ethylamino]ethyl-dimethyl-ammonium Formula: C12H19BrClN2O+ MolecularWeight: 322.64906

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNCCOC1=C(C=C(C=C1)Br)Cl

Isomeric SMILES

C[NH+](C)CCNCCOC1=C(C=C(C=C1)Br)Cl

InChI

InChI=1S/C12H18BrClN2O/c1-16(2)7-5-15-6-8-17-12-4-3-10(13)9-11(12)14/h3-4,9,15H,5-8H2,1-2H3/p+1