[4-(5-pentylpyridin-2-yl)phenyl] (E)-9-cyclohexylnon-2-enoate

Systemtic Name: [4-(5-pentylpyridin-2-yl)phenyl] (E)-9-cyclohexylnon-2-enoate Openeye Name: [4-(5-pentyl-2-pyridyl)phenyl] (E)-9-cyclohexylnon-2-enoate CAS Name: (E)-9-cyclohexyl-2-nonenoic acid [4-(5-pentyl-2-pyridinyl)phenyl] ester IUPAC Name: [4-(5-pentylpyridin-2-yl)phenyl] (E)-9-cyclohexylnon-2-enoate Traditional Name: (E)-9-cyclohexylnon-2-enoic acid [4-(5-amyl-2-pyridyl)phenyl] ester Formula: C31H43NO2 MolecularWeight: 461.67862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)OC(=O)C=CCCCCCCC3CCCCC3

Isomeric SMILES

CCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)OC(=O)/C=C/CCCCCCC3CCCCC3

InChI

InChI=1S/C31H43NO2/c1-2-3-9-17-27-19-24-30(32-25-27)28-20-22-29(23-21-28)34-31(33)18-13-7-5-4-6-10-14-26-15-11-8-12-16-26/h13,18-26H,2-12,14-17H2,1H3/b18-13+