2-[2-[4-[(5-bromanyl-2-methoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]ethoxy]ethanol

Systemtic Name: 2-[2-[4-[(5-bromanyl-2-methoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]ethoxy]ethanol Openeye Name: 2-[2-[4-[(5-bromo-2-methoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]ethoxy]ethanol CAS Name: 2-[2-[4-[(5-bromo-2-methoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]ethoxy]ethanol IUPAC Name: 2-[2-[4-[(5-bromo-2-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]ethoxy]ethanol Traditional Name: 2-[2-[4-(5-bromo-2-methoxy-benzyl)piperazine-1,4-diium-1-yl]ethoxy]ethanol Formula: C16H27BrN2O3+2 MolecularWeight: 375.30118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C[NH+]2CC[NH+](CC2)CCOCCO

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C[NH+]2CC[NH+](CC2)CCOCCO

InChI

InChI=1S/C16H25BrN2O3/c1-21-16-3-2-15(17)12-14(16)13-19-6-4-18(5-7-19)8-10-22-11-9-20/h2-3,12,20H,4-11,13H2,1H3/p+2