2-[5-bromanyl-2-(methoxymethoxy)phenyl]-2-[3-(trifluoromethyl)pyridin-2-yl]ethanenitrile

Systemtic Name: 2-[5-bromanyl-2-(methoxymethoxy)phenyl]-2-[3-(trifluoromethyl)pyridin-2-yl]ethanenitrile Openeye Name: 2-[5-bromo-2-(methoxymethoxy)phenyl]-2-[3-(trifluoromethyl)-2-pyridyl]acetonitrile CAS Name: 2-[5-bromo-2-(methoxymethoxy)phenyl]-2-[3-(trifluoromethyl)-2-pyridinyl]acetonitrile IUPAC Name: 2-[5-bromo-2-(methoxymethoxy)phenyl]-2-[3-(trifluoromethyl)pyridin-2-yl]acetonitrile Traditional Name: 2-[5-bromo-2-(methoxymethoxy)phenyl]-2-[3-(trifluoromethyl)-2-pyridyl]acetonitrile Formula: C16H12BrF3N2O2 MolecularWeight: 401.17789

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Descriptors Computed from Structure

Canonical SMILES:

COCOC1=C(C=C(C=C1)Br)C(C#N)C2=C(C=CC=N2)C(F)(F)F

Isomeric SMILES

COCOC1=C(C=C(C=C1)Br)C(C#N)C2=C(C=CC=N2)C(F)(F)F

InChI

InChI=1S/C16H12BrF3N2O2/c1-23-9-24-14-5-4-10(17)7-11(14)12(8-21)15-13(16(18,19)20)3-2-6-22-15/h2-7,12H,9H2,1H3