5-[2-[4-(4-heptylcyclohexyl)cyclohexyl]ethynyl]-2-(trifluoromethyl)pyridine

Systemtic Name: 5-[2-[4-(4-heptylcyclohexyl)cyclohexyl]ethynyl]-2-(trifluoromethyl)pyridine Openeye Name: 5-[2-[4-(4-heptylcyclohexyl)cyclohexyl]ethynyl]-2-(trifluoromethyl)pyridine CAS Name: 5-[2-[4-(4-heptylcyclohexyl)cyclohexyl]ethynyl]-2-(trifluoromethyl)pyridine IUPAC Name: 5-[2-[4-(4-heptylcyclohexyl)cyclohexyl]ethynyl]-2-(trifluoromethyl)pyridine Traditional Name: 5-[2-[4-(4-heptylcyclohexyl)cyclohexyl]ethynyl]-2-(trifluoromethyl)pyridine Formula: C27H38F3N MolecularWeight: 433.59253

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C2CCC(CC2)C#CC3=CN=C(C=C3)C(F)(F)F

Isomeric SMILES

CCCCCCCC1CCC(CC1)C2CCC(CC2)C#CC3=CN=C(C=C3)C(F)(F)F

InChI

InChI=1S/C27H38F3N/c1-2-3-4-5-6-7-21-10-15-24(16-11-21)25-17-12-22(13-18-25)8-9-23-14-19-26(31-20-23)27(28,29)30/h14,19-22,24-25H,2-7,10-13,15-18H2,1H3