1-(2-fluoranyl-2-methyl-heptoxy)-4-[4-(4-heptyl-4-isocyano-cyclohexyl)phenyl]benzene

Systemtic Name: 1-(2-fluoranyl-2-methyl-heptoxy)-4-[4-(4-heptyl-4-isocyano-cyclohexyl)phenyl]benzene Openeye Name: 1-(2-fluoro-2-methyl-heptoxy)-4-[4-(4-heptyl-4-isocyano-cyclohexyl)phenyl]benzene CAS Name: 1-(2-fluoro-2-methylheptoxy)-4-[4-(4-heptyl-4-isocyanocyclohexyl)phenyl]benzene IUPAC Name: 1-(2-fluoro-2-methylheptoxy)-4-[4-(4-heptyl-4-isocyanocyclohexyl)phenyl]benzene Traditional Name: 1-(2-fluoro-2-methyl-heptoxy)-4-[4-(4-heptyl-4-isocyano-cyclohexyl)phenyl]benzene Formula: C34H48FNO MolecularWeight: 505.749423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)OCC(C)(CCCCC)F)[N+]#[C-]

Isomeric SMILES

CCCCCCCC1(CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)OCC(C)(CCCCC)F)[N+]#[C-]

InChI

InChI=1S/C34H48FNO/c1-5-7-9-10-12-24-34(36-4)25-21-31(22-26-34)29-15-13-28(14-16-29)30-17-19-32(20-18-30)37-27-33(3,35)23-11-8-6-2/h13-20,31H,5-12,21-27H2,1-3H3