2-[1-(3,3-diphenylpropyl)piperidin-4-yl]-3,4-dihydroisoquinolin-1-one

Systemtic Name: 2-[1-(3,3-diphenylpropyl)piperidin-4-yl]-3,4-dihydroisoquinolin-1-one Openeye Name: 2-[1-(3,3-diphenylpropyl)-4-piperidyl]-3,4-dihydroisoquinolin-1-one CAS Name: 2-[1-(3,3-diphenylpropyl)-4-piperidinyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-[1-(3,3-diphenylpropyl)piperidin-4-yl]-3,4-dihydroisoquinolin-1-one Traditional Name: 2-[1-(3,3-diphenylpropyl)-4-piperidyl]-3,4-dihydroisocarbostyril Formula: C29H32N2O MolecularWeight: 424.57718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CCC3=CC=CC=C3C2=O)CCC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1N2CCC3=CC=CC=C3C2=O)CCC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H32N2O/c32-29-28-14-8-7-13-25(28)15-22-31(29)26-16-19-30(20-17-26)21-18-27(23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-14,26-27H,15-22H2