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

Systemtic Name: 2-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]isoquinolin-1-one Openeye Name: 2-[2-(4-benzyl-1-piperidyl)-2-oxo-ethyl]isoquinolin-1-one CAS Name: 2-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-1-isoquinolinone IUPAC Name: 2-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]isoquinolin-1-one Traditional Name: 2-[2-(4-benzylpiperidino)-2-keto-ethyl]isocarbostyril Formula: C23H24N2O2 MolecularWeight: 360.44886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)CN3C=CC4=CC=CC=C4C3=O

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)CN3C=CC4=CC=CC=C4C3=O

InChI

InChI=1S/C23H24N2O2/c26-22(17-25-15-12-20-8-4-5-9-21(20)23(25)27)24-13-10-19(11-14-24)16-18-6-2-1-3-7-18/h1-9,12,15,19H,10-11,13-14,16-17H2