2,4-bis(bromanyl)-6-[[(5-iodanyl-3-methyl-pyridin-1-ium-2-yl)amino]methyl]phenol

Systemtic Name: 2,4-bis(bromanyl)-6-[[(5-iodanyl-3-methyl-pyridin-1-ium-2-yl)amino]methyl]phenol Openeye Name: 2,4-dibromo-6-[[(5-iodo-3-methyl-pyridin-1-ium-2-yl)amino]methyl]phenol CAS Name: 2,4-dibromo-6-[[(5-iodo-3-methyl-2-pyridin-1-iumyl)amino]methyl]phenol IUPAC Name: 2,4-dibromo-6-[[(5-iodo-3-methylpyridin-1-ium-2-yl)amino]methyl]phenol Traditional Name: 2,4-dibromo-6-[[(5-iodo-3-methyl-pyridin-1-ium-2-yl)amino]methyl]phenol Formula: C13H12Br2IN2O+ MolecularWeight: 498.95965

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C[NH+]=C1NCC2=CC(=CC(=C2O)Br)Br)I

Isomeric SMILES

CC1=CC(=C[NH+]=C1NCC2=CC(=CC(=C2O)Br)Br)I

InChI

InChI=1S/C13H11Br2IN2O/c1-7-2-10(16)6-18-13(7)17-5-8-3-9(14)4-11(15)12(8)19/h2-4,6,19H,5H2,1H3,(H,17,18)/p+1