3-(4-oct-1-ynylphenyl)-6-[4-(4-oct-1-ynylphenyl)phenyl]-4-(trifluoromethyl)pyridazine

Systemtic Name: 3-(4-oct-1-ynylphenyl)-6-[4-(4-oct-1-ynylphenyl)phenyl]-4-(trifluoromethyl)pyridazine Openeye Name: 3-(4-oct-1-ynylphenyl)-6-[4-(4-oct-1-ynylphenyl)phenyl]-4-(trifluoromethyl)pyridazine CAS Name: 3-(4-oct-1-ynylphenyl)-6-[4-(4-oct-1-ynylphenyl)phenyl]-4-(trifluoromethyl)pyridazine IUPAC Name: 3-(4-oct-1-ynylphenyl)-6-[4-(4-oct-1-ynylphenyl)phenyl]-4-(trifluoromethyl)pyridazine Traditional Name: 3-(4-oct-1-ynylphenyl)-6-[4-(4-oct-1-ynylphenyl)phenyl]-4-(trifluoromethyl)pyridazine Formula: C39H39F3N2 MolecularWeight: 592.73557

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NN=C(C(=C3)C(F)(F)F)C4=CC=C(C=C4)C#CCCCCCC

Isomeric SMILES

CCCCCCC#CC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NN=C(C(=C3)C(F)(F)F)C4=CC=C(C=C4)C#CCCCCCC

InChI

InChI=1S/C39H39F3N2/c1-3-5-7-9-11-13-15-30-17-21-32(22-18-30)33-25-27-34(28-26-33)37-29-36(39(40,41)42)38(44-43-37)35-23-19-31(20-24-35)16-14-12-10-8-6-4-2/h17-29H,3-12H2,1-2H3