1-[2-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)ethyl]-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-[2-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)ethyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[2-(2-bromo-6-chloro-4-methyl-phenoxy)ethyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[2-(2-bromo-6-chloro-4-methylphenoxy)ethyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[2-(2-bromo-6-chloro-4-methylphenoxy)ethyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-[2-(2-bromo-6-chloro-4-methyl-phenoxy)ethyl]-4-methyl-piperazine-1,4-diium Formula: C14H22BrClN2O+2 MolecularWeight: 349.69428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCC[NH+]2CC[NH+](CC2)C)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCC[NH+]2CC[NH+](CC2)C)Cl

InChI

InChI=1S/C14H20BrClN2O/c1-11-9-12(15)14(13(16)10-11)19-8-7-18-5-3-17(2)4-6-18/h9-10H,3-8H2,1-2H3/p+2