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

Systemtic Name: 3-oxidanyl-2-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-3H-benzo[de]isoquinolin-1-one Openeye Name: 2-[2-(4-benzylpiperazin-1-yl)ethyl]-3-hydroxy-3H-benzo[de]isoquinolin-1-one CAS Name: 3-hydroxy-2-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-3H-benzo[de]isoquinolin-1-one IUPAC Name: 2-[2-(4-benzylpiperazin-1-yl)ethyl]-3-hydroxy-3H-benzo[de]isoquinolin-1-one Traditional Name: 2-[2-(4-benzylpiperazino)ethyl]-3-hydroxy-3H-benzo[de]isoquinolin-1-one Formula: C25H27N3O2 MolecularWeight: 401.50078

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCN2C(C3=CC=CC4=C3C(=CC=C4)C2=O)O)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCN2C(C3=CC=CC4=C3C(=CC=C4)C2=O)O)CC5=CC=CC=C5

InChI

InChI=1S/C25H27N3O2/c29-24-21-10-4-8-20-9-5-11-22(23(20)21)25(30)28(24)17-16-26-12-14-27(15-13-26)18-19-6-2-1-3-7-19/h1-11,24,29H,12-18H2