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

Systemtic Name: 2-[4-[1-[(5-bromanyl-2-methoxy-phenyl)methyl]piperidin-1-ium-4-yl]piperazine-1,4-diium-1-yl]ethanol Openeye Name: 2-[4-[1-[(5-bromo-2-methoxy-phenyl)methyl]piperidin-1-ium-4-yl]piperazine-1,4-diium-1-yl]ethanol CAS Name: 2-[4-[1-[(5-bromo-2-methoxyphenyl)methyl]-4-piperidin-1-iumyl]-1-piperazine-1,4-diiumyl]ethanol IUPAC Name: 2-[4-[1-[(5-bromo-2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]piperazine-1,4-diium-1-yl]ethanol Traditional Name: 2-[4-[1-(5-bromo-2-methoxy-benzyl)piperidin-1-ium-4-yl]piperazine-1,4-diium-1-yl]ethanol Formula: C19H33BrN3O2+3 MolecularWeight: 415.38822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C[NH+]2CCC(CC2)[NH+]3CC[NH+](CC3)CCO

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C[NH+]2CCC(CC2)[NH+]3CC[NH+](CC3)CCO

InChI

InChI=1S/C19H30BrN3O2/c1-25-19-3-2-17(20)14-16(19)15-22-6-4-18(5-7-22)23-10-8-21(9-11-23)12-13-24/h2-3,14,18,24H,4-13,15H2,1H3/p+3