2-[3,4-bis(fluoranyl)phenyl]-5-oct-1-ynyl-pyrimidine

Systemtic Name: 2-[3,4-bis(fluoranyl)phenyl]-5-oct-1-ynyl-pyrimidine Openeye Name: 2-(3,4-difluorophenyl)-5-oct-1-ynyl-pyrimidine CAS Name: 2-(3,4-difluorophenyl)-5-oct-1-ynylpyrimidine IUPAC Name: 2-(3,4-difluorophenyl)-5-oct-1-ynylpyrimidine Traditional Name: 2-(3,4-difluorophenyl)-5-oct-1-ynyl-pyrimidine Formula: C18H18F2N2 MolecularWeight: 300.345726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC1=CN=C(N=C1)C2=CC(=C(C=C2)F)F

Isomeric SMILES

CCCCCCC#CC1=CN=C(N=C1)C2=CC(=C(C=C2)F)F

InChI

InChI=1S/C18H18F2N2/c1-2-3-4-5-6-7-8-14-12-21-18(22-13-14)15-9-10-16(19)17(20)11-15/h9-13H,2-6H2,1H3