2-[4-[(3-bromanyl-4-methoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]ethanol

Systemtic Name: 2-[4-[(3-bromanyl-4-methoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]ethanol Openeye Name: 2-[4-[(3-bromo-4-methoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]ethanol CAS Name: 2-[4-[(3-bromo-4-methoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]ethanol IUPAC Name: 2-[4-[(3-bromo-4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]ethanol Traditional Name: 2-[4-(3-bromo-4-methoxy-benzyl)piperazine-1,4-diium-1-yl]ethanol Formula: C14H23BrN2O2+2 MolecularWeight: 331.24862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21BrN2O2/c1-19-14-3-2-12(10-13(14)15)11-17-6-4-16(5-7-17)8-9-18/h2-3,10,18H,4-9,11H2,1H3/p+2