2-[[1-[[2-(phenylcarbonyl)phenyl]methyl]piperidin-4-yl]methyl]-3H-isoindol-1-one

Systemtic Name: 2-[[1-[[2-(phenylcarbonyl)phenyl]methyl]piperidin-4-yl]methyl]-3H-isoindol-1-one Openeye Name: 2-[[1-[(2-benzoylphenyl)methyl]-4-piperidyl]methyl]isoindolin-1-one CAS Name: 2-[[1-[(2-benzoylphenyl)methyl]-4-piperidinyl]methyl]-3H-isoindol-1-one IUPAC Name: 2-[[1-[(2-benzoylphenyl)methyl]piperidin-4-yl]methyl]-3H-isoindol-1-one Traditional Name: 2-[[1-(2-benzoylbenzyl)-4-piperidyl]methyl]isoindolin-1-one Formula: C28H28N2O2 MolecularWeight: 424.53412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2CC3=CC=CC=C3C2=O)CC4=CC=CC=C4C(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1CN2CC3=CC=CC=C3C2=O)CC4=CC=CC=C4C(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H28N2O2/c31-27(22-8-2-1-3-9-22)25-12-6-4-10-23(25)19-29-16-14-21(15-17-29)18-30-20-24-11-5-7-13-26(24)28(30)32/h1-13,21H,14-20H2