2,5-bis(fluoranyl)-4-(3,4,5-trimethylpyrazol-1-yl)benzenecarbonitrile

Systemtic Name: 2,5-bis(fluoranyl)-4-(3,4,5-trimethylpyrazol-1-yl)benzenecarbonitrile Openeye Name: 2,5-difluoro-4-(3,4,5-trimethylpyrazol-1-yl)benzonitrile CAS Name: 2,5-difluoro-4-(3,4,5-trimethyl-1-pyrazolyl)benzonitrile IUPAC Name: 2,5-difluoro-4-(3,4,5-trimethylpyrazol-1-yl)benzonitrile Traditional Name: 2,5-difluoro-4-(3,4,5-trimethylpyrazol-1-yl)benzonitrile Formula: C13H11F2N3 MolecularWeight: 247.243346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C)C2=C(C=C(C(=C2)F)C#N)F)C

Isomeric SMILES

CC1=C(N(N=C1C)C2=C(C=C(C(=C2)F)C#N)F)C

InChI

InChI=1S/C13H11F2N3/c1-7-8(2)17-18(9(7)3)13-5-11(14)10(6-16)4-12(13)15/h4-5H,1-3H3