3-[3-bromanyl-2-fluoranyl-6-[(4-methyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)methoxy]phenoxy]-5-ethyl-benzenecarbonitrile

Systemtic Name: 3-[3-bromanyl-2-fluoranyl-6-[(4-methyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)methoxy]phenoxy]-5-ethyl-benzenecarbonitrile Openeye Name: 3-[3-bromo-2-fluoro-6-[(4-methyl-5-oxo-1H-1,2,4-triazol-3-yl)methoxy]phenoxy]-5-ethyl-benzonitrile CAS Name: 3-[3-bromo-2-fluoro-6-[(4-methyl-5-oxo-1H-1,2,4-triazol-3-yl)methoxy]phenoxy]-5-ethylbenzonitrile IUPAC Name: 3-[3-bromo-2-fluoro-6-[(4-methyl-5-oxo-1H-1,2,4-triazol-3-yl)methoxy]phenoxy]-5-ethylbenzonitrile Traditional Name: 3-[3-bromo-2-fluoro-6-[(5-keto-4-methyl-1H-1,2,4-triazol-3-yl)methoxy]phenoxy]-5-ethyl-benzonitrile Formula: C19H16BrFN4O3 MolecularWeight: 447.257743

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1)C#N)OC2=C(C=CC(=C2F)Br)OCC3=NNC(=O)N3C

Isomeric SMILES

CCC1=CC(=CC(=C1)C#N)OC2=C(C=CC(=C2F)Br)OCC3=NNC(=O)N3C

InChI

InChI=1S/C19H16BrFN4O3/c1-3-11-6-12(9-22)8-13(7-11)28-18-15(5-4-14(20)17(18)21)27-10-16-23-24-19(26)25(16)2/h4-8H,3,10H2,1-2H3,(H,24,26)