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

Systemtic Name: 1-[2-[2-(4-bromanyl-2-methyl-phenoxy)ethoxy]ethyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[2-[2-(4-bromo-2-methyl-phenoxy)ethoxy]ethyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[2-[2-(4-bromo-2-methylphenoxy)ethoxy]ethyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[2-[2-(4-bromo-2-methylphenoxy)ethoxy]ethyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-[2-[2-(4-bromo-2-methyl-phenoxy)ethoxy]ethyl]-4-methyl-piperazine-1,4-diium Formula: C16H27BrN2O2+2 MolecularWeight: 359.30178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25BrN2O2/c1-14-13-15(17)3-4-16(14)21-12-11-20-10-9-19-7-5-18(2)6-8-19/h3-4,13H,5-12H2,1-2H3/p+2