2-[[[3,5-bis(bromanyl)pyridin-1-ium-2-yl]amino]methyl]-5-methoxy-phenol

Systemtic Name: 2-[[[3,5-bis(bromanyl)pyridin-1-ium-2-yl]amino]methyl]-5-methoxy-phenol Openeye Name: 2-[[(3,5-dibromopyridin-1-ium-2-yl)amino]methyl]-5-methoxy-phenol CAS Name: 2-[[(3,5-dibromo-2-pyridin-1-iumyl)amino]methyl]-5-methoxyphenol IUPAC Name: 2-[[(3,5-dibromopyridin-1-ium-2-yl)amino]methyl]-5-methoxyphenol Traditional Name: 2-[[(3,5-dibromopyridin-1-ium-2-yl)amino]methyl]-5-methoxy-phenol Formula: C13H13Br2N2O2+ MolecularWeight: 389.06252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC2=C(C=C(C=[NH+]2)Br)Br)O

Isomeric SMILES

COC1=CC(=C(C=C1)CNC2=C(C=C(C=[NH+]2)Br)Br)O

InChI

InChI=1S/C13H12Br2N2O2/c1-19-10-3-2-8(12(18)5-10)6-16-13-11(15)4-9(14)7-17-13/h2-5,7,18H,6H2,1H3,(H,16,17)/p+1