3-oxidanyl-2-[2-[4-(phenylmethyl)piperidin-1-yl]ethyl]-3H-benzo[de]isoquinolin-1-one

Systemtic Name: 3-oxidanyl-2-[2-[4-(phenylmethyl)piperidin-1-yl]ethyl]-3H-benzo[de]isoquinolin-1-one Openeye Name: 2-[2-(4-benzyl-1-piperidyl)ethyl]-3-hydroxy-3H-benzo[de]isoquinolin-1-one CAS Name: 3-hydroxy-2-[2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-3H-benzo[de]isoquinolin-1-one IUPAC Name: 2-[2-(4-benzylpiperidin-1-yl)ethyl]-3-hydroxy-3H-benzo[de]isoquinolin-1-one Traditional Name: 2-[2-(4-benzylpiperidino)ethyl]-3-hydroxy-3H-benzo[de]isoquinolin-1-one Formula: C26H28N2O2 MolecularWeight: 400.51272

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CCN3C(C4=CC=CC5=C4C(=CC=C5)C3=O)O

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CCN3C(C4=CC=CC5=C4C(=CC=C5)C3=O)O

InChI

InChI=1S/C26H28N2O2/c29-25-22-10-4-8-21-9-5-11-23(24(21)22)26(30)28(25)17-16-27-14-12-20(13-15-27)18-19-6-2-1-3-7-19/h1-11,20,25,29H,12-18H2