2-[[[3,5-bis(bromanyl)pyridin-1-ium-2-yl]amino]methyl]-4-bromanyl-phenol

Systemtic Name: 2-[[[3,5-bis(bromanyl)pyridin-1-ium-2-yl]amino]methyl]-4-bromanyl-phenol Openeye Name: 4-bromo-2-[[(3,5-dibromopyridin-1-ium-2-yl)amino]methyl]phenol CAS Name: 4-bromo-2-[[(3,5-dibromo-2-pyridin-1-iumyl)amino]methyl]phenol IUPAC Name: 4-bromo-2-[[(3,5-dibromopyridin-1-ium-2-yl)amino]methyl]phenol Traditional Name: 4-bromo-2-[[(3,5-dibromopyridin-1-ium-2-yl)amino]methyl]phenol Formula: C12H10Br3N2O+ MolecularWeight: 437.9326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)CNC2=C(C=C(C=[NH+]2)Br)Br)O

Isomeric SMILES

C1=CC(=C(C=C1Br)CNC2=C(C=C(C=[NH+]2)Br)Br)O

InChI

InChI=1S/C12H9Br3N2O/c13-8-1-2-11(18)7(3-8)5-16-12-10(15)4-9(14)6-17-12/h1-4,6,18H,5H2,(H,16,17)/p+1