[3-[1-[3-(1-benzofuran-2-yl)propyl]piperidin-3-yl]phenyl] benzoate

Systemtic Name: [3-[1-[3-(1-benzofuran-2-yl)propyl]piperidin-3-yl]phenyl] benzoate Openeye Name: [3-[1-[3-(benzofuran-2-yl)propyl]-3-piperidyl]phenyl] benzoate CAS Name: benzoic acid [3-[1-[3-(2-benzofuranyl)propyl]-3-piperidinyl]phenyl] ester IUPAC Name: [3-[1-[3-(1-benzofuran-2-yl)propyl]piperidin-3-yl]phenyl] benzoate Traditional Name: benzoic acid [3-[1-[3-(benzofuran-2-yl)propyl]-3-piperidyl]phenyl] ester Formula: C29H29NO3 MolecularWeight: 439.54546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCCC2=CC3=CC=CC=C3O2)C4=CC(=CC=C4)OC(=O)C5=CC=CC=C5

Isomeric SMILES

C1CC(CN(C1)CCCC2=CC3=CC=CC=C3O2)C4=CC(=CC=C4)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H29NO3/c31-29(22-9-2-1-3-10-22)33-27-14-6-12-23(19-27)25-13-7-17-30(21-25)18-8-15-26-20-24-11-4-5-16-28(24)32-26/h1-6,9-12,14,16,19-20,25H,7-8,13,15,17-18,21H2