2-[2-[1-(phenylmethyl)piperidin-4-yl]ethyl]isoquinolin-1-one

Systemtic Name: 2-[2-[1-(phenylmethyl)piperidin-4-yl]ethyl]isoquinolin-1-one Openeye Name: 2-[2-(1-benzyl-4-piperidyl)ethyl]isoquinolin-1-one CAS Name: 2-[2-[1-(phenylmethyl)-4-piperidinyl]ethyl]-1-isoquinolinone IUPAC Name: 2-[2-(1-benzylpiperidin-4-yl)ethyl]isoquinolin-1-one Traditional Name: 2-[2-(1-benzyl-4-piperidyl)ethyl]isocarbostyril Formula: C23H26N2O MolecularWeight: 346.46534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCN2C=CC3=CC=CC=C3C2=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1CCN2C=CC3=CC=CC=C3C2=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H26N2O/c26-23-22-9-5-4-8-21(22)13-17-25(23)16-12-19-10-14-24(15-11-19)18-20-6-2-1-3-7-20/h1-9,13,17,19H,10-12,14-16,18H2