[2-[4-(2-piperidin-2-ylethyl)phenoxy]phenyl] hexanoate

Systemtic Name: [2-[4-(2-piperidin-2-ylethyl)phenoxy]phenyl] hexanoate Openeye Name: [2-[4-[2-(2-piperidyl)ethyl]phenoxy]phenyl] hexanoate CAS Name: hexanoic acid [2-[4-[2-(2-piperidinyl)ethyl]phenoxy]phenyl] ester IUPAC Name: [2-[4-(2-piperidin-2-ylethyl)phenoxy]phenyl] hexanoate Traditional Name: hexanoic acid [2-[4-[2-(2-piperidyl)ethyl]phenoxy]phenyl] ester Formula: C25H33NO3 MolecularWeight: 395.53442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1=CC=CC=C1OC2=CC=C(C=C2)CCC3CCCCN3

Isomeric SMILES

CCCCCC(=O)OC1=CC=CC=C1OC2=CC=C(C=C2)CCC3CCCCN3

InChI

InChI=1S/C25H33NO3/c1-2-3-4-12-25(27)29-24-11-6-5-10-23(24)28-22-17-14-20(15-18-22)13-16-21-9-7-8-19-26-21/h5-6,10-11,14-15,17-18,21,26H,2-4,7-9,12-13,16,19H2,1H3