2-[2-(bromomethyl)-6-[6-(bromomethyl)pyridin-2-yl]pyridin-4-yl]oxyethyl benzoate

Systemtic Name: 2-[2-(bromomethyl)-6-[6-(bromomethyl)pyridin-2-yl]pyridin-4-yl]oxyethyl benzoate Openeye Name: 2-[[2-(bromomethyl)-6-[6-(bromomethyl)-2-pyridyl]-4-pyridyl]oxy]ethyl benzoate CAS Name: benzoic acid 2-[[2-(bromomethyl)-6-[6-(bromomethyl)-2-pyridinyl]-4-pyridinyl]oxy]ethyl ester IUPAC Name: 2-[2-(bromomethyl)-6-[6-(bromomethyl)pyridin-2-yl]pyridin-4-yl]oxyethyl benzoate Traditional Name: benzoic acid 2-[[2-(bromomethyl)-6-[6-(bromomethyl)-2-pyridyl]-4-pyridyl]oxy]ethyl ester Formula: C21H18Br2N2O3 MolecularWeight: 506.18722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCOC2=CC(=NC(=C2)CBr)C3=NC(=CC=C3)CBr

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCOC2=CC(=NC(=C2)CBr)C3=NC(=CC=C3)CBr

InChI

InChI=1S/C21H18Br2N2O3/c22-13-16-7-4-8-19(24-16)20-12-18(11-17(14-23)25-20)27-9-10-28-21(26)15-5-2-1-3-6-15/h1-8,11-12H,9-10,13-14H2