[4-[2-(5-pentylpyridin-2-yl)ethyl]phenyl] 4-butylcyclohexane-1-carboxylate

Systemtic Name: [4-[2-(5-pentylpyridin-2-yl)ethyl]phenyl] 4-butylcyclohexane-1-carboxylate Openeye Name: [4-[2-(5-pentyl-2-pyridyl)ethyl]phenyl] 4-butylcyclohexanecarboxylate CAS Name: 4-butyl-1-cyclohexanecarboxylic acid [4-[2-(5-pentyl-2-pyridinyl)ethyl]phenyl] ester IUPAC Name: [4-[2-(5-pentylpyridin-2-yl)ethyl]phenyl] 4-butylcyclohexane-1-carboxylate Traditional Name: 4-butylcyclohexanecarboxylic acid [4-[2-(5-amyl-2-pyridyl)ethyl]phenyl] ester Formula: C29H41NO2 MolecularWeight: 435.64134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(C=C1)CCC2=CC=C(C=C2)OC(=O)C3CCC(CC3)CCCC

Isomeric SMILES

CCCCCC1=CN=C(C=C1)CCC2=CC=C(C=C2)OC(=O)C3CCC(CC3)CCCC

InChI

InChI=1S/C29H41NO2/c1-3-5-7-9-25-13-19-27(30-22-25)18-12-24-14-20-28(21-15-24)32-29(31)26-16-10-23(11-17-26)8-6-4-2/h13-15,19-23,26H,3-12,16-18H2,1-2H3