2-[1-(5-bromanyl-2-oxidanyl-phenyl)propylamino]-6-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[1-(5-bromanyl-2-oxidanyl-phenyl)propylamino]-6-fluoranyl-benzenecarbonitrile Openeye Name: 2-[1-(5-bromo-2-hydroxy-phenyl)propylamino]-6-fluoro-benzonitrile CAS Name: 2-[1-(5-bromo-2-hydroxyphenyl)propylamino]-6-fluorobenzonitrile IUPAC Name: 2-[1-(5-bromo-2-hydroxyphenyl)propylamino]-6-fluorobenzonitrile Traditional Name: 2-[1-(5-bromo-2-hydroxy-phenyl)propylamino]-6-fluoro-benzonitrile Formula: C16H14BrFN2O MolecularWeight: 349.197563

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=CC(=C1)Br)O)NC2=C(C(=CC=C2)F)C#N

Isomeric SMILES

CCC(C1=C(C=CC(=C1)Br)O)NC2=C(C(=CC=C2)F)C#N

InChI

InChI=1S/C16H14BrFN2O/c1-2-14(11-8-10(17)6-7-16(11)21)20-15-5-3-4-13(18)12(15)9-19/h3-8,14,20-21H,2H2,1H3