ethyl 3-[2-(6-bromanylpyridin-2-yl)-1-oxidanyl-ethyl]benzoate

Systemtic Name: ethyl 3-[2-(6-bromanylpyridin-2-yl)-1-oxidanyl-ethyl]benzoate Openeye Name: ethyl 3-[2-(6-bromo-2-pyridyl)-1-hydroxy-ethyl]benzoate CAS Name: 3-[2-(6-bromo-2-pyridinyl)-1-hydroxyethyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[2-(6-bromopyridin-2-yl)-1-hydroxyethyl]benzoate Traditional Name: 3-[2-(6-bromo-2-pyridyl)-1-hydroxy-ethyl]benzoic acid ethyl ester Formula: C16H16BrNO3 MolecularWeight: 350.20714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)C(CC2=NC(=CC=C2)Br)O

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)C(CC2=NC(=CC=C2)Br)O

InChI

InChI=1S/C16H16BrNO3/c1-2-21-16(20)12-6-3-5-11(9-12)14(19)10-13-7-4-8-15(17)18-13/h3-9,14,19H,2,10H2,1H3