5-hex-1-ynyl-2-[4-(trifluoromethyl)phenyl]pyrimidine

Systemtic Name: 5-hex-1-ynyl-2-[4-(trifluoromethyl)phenyl]pyrimidine Openeye Name: 5-hex-1-ynyl-2-[4-(trifluoromethyl)phenyl]pyrimidine CAS Name: 5-hex-1-ynyl-2-[4-(trifluoromethyl)phenyl]pyrimidine IUPAC Name: 5-hex-1-ynyl-2-[4-(trifluoromethyl)phenyl]pyrimidine Traditional Name: 5-hex-1-ynyl-2-[4-(trifluoromethyl)phenyl]pyrimidine Formula: C17H15F3N2 MolecularWeight: 304.30961

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15F3N2/c1-2-3-4-5-6-13-11-21-16(22-12-13)14-7-9-15(10-8-14)17(18,19)20/h7-12H,2-4H2,1H3