4-[1-(5-bromanyl-4-prop-2-enyl-pyridin-3-yl)-1-oxidanyl-ethyl]-2-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-[1-(5-bromanyl-4-prop-2-enyl-pyridin-3-yl)-1-oxidanyl-ethyl]-2-fluoranyl-benzenecarbonitrile Openeye Name: 4-[1-(4-allyl-5-bromo-3-pyridyl)-1-hydroxy-ethyl]-2-fluoro-benzonitrile CAS Name: 4-[1-(5-bromo-4-prop-2-enyl-3-pyridinyl)-1-hydroxyethyl]-2-fluorobenzonitrile IUPAC Name: 4-[1-(5-bromo-4-prop-2-enylpyridin-3-yl)-1-hydroxyethyl]-2-fluorobenzonitrile Traditional Name: 4-[1-(4-allyl-5-bromo-3-pyridyl)-1-hydroxy-ethyl]-2-fluoro-benzonitrile Formula: C17H14BrFN2O MolecularWeight: 361.208263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)C#N)F)(C2=CN=CC(=C2CC=C)Br)O

Isomeric SMILES

CC(C1=CC(=C(C=C1)C#N)F)(C2=CN=CC(=C2CC=C)Br)O

InChI

InChI=1S/C17H14BrFN2O/c1-3-4-13-14(9-21-10-15(13)18)17(2,22)12-6-5-11(8-20)16(19)7-12/h3,5-7,9-10,22H,1,4H2,2H3