2-[4-[1-[(4-bromophenyl)methyl]piperidin-1-ium-4-yl]piperazine-1,4-diium-1-yl]ethanol

Systemtic Name: 2-[4-[1-[(4-bromophenyl)methyl]piperidin-1-ium-4-yl]piperazine-1,4-diium-1-yl]ethanol Openeye Name: 2-[4-[1-[(4-bromophenyl)methyl]piperidin-1-ium-4-yl]piperazine-1,4-diium-1-yl]ethanol CAS Name: 2-[4-[1-[(4-bromophenyl)methyl]-4-piperidin-1-iumyl]-1-piperazine-1,4-diiumyl]ethanol IUPAC Name: 2-[4-[1-[(4-bromophenyl)methyl]piperidin-1-ium-4-yl]piperazine-1,4-diium-1-yl]ethanol Traditional Name: 2-[4-[1-(4-bromobenzyl)piperidin-1-ium-4-yl]piperazine-1,4-diium-1-yl]ethanol Formula: C18H31BrN3O+3 MolecularWeight: 385.36224

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1[NH+]2CC[NH+](CC2)CCO)CC3=CC=C(C=C3)Br

Isomeric SMILES

C1C[NH+](CCC1[NH+]2CC[NH+](CC2)CCO)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H28BrN3O/c19-17-3-1-16(2-4-17)15-21-7-5-18(6-8-21)22-11-9-20(10-12-22)13-14-23/h1-4,18,23H,5-15H2/p+3