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

Systemtic Name: 2-[2-[4-(2-bromophenyl)piperidin-1-yl]ethyl]-3-oxidanyl-3H-benzo[de]isoquinolin-1-one Openeye Name: 2-[2-[4-(2-bromophenyl)-1-piperidyl]ethyl]-3-hydroxy-3H-benzo[de]isoquinolin-1-one CAS Name: 2-[2-[4-(2-bromophenyl)-1-piperidinyl]ethyl]-3-hydroxy-3H-benzo[de]isoquinolin-1-one IUPAC Name: 2-[2-[4-(2-bromophenyl)piperidin-1-yl]ethyl]-3-hydroxy-3H-benzo[de]isoquinolin-1-one Traditional Name: 2-[2-[4-(2-bromophenyl)piperidino]ethyl]-3-hydroxy-3H-benzo[de]isoquinolin-1-one Formula: C25H25BrN2O2 MolecularWeight: 465.3822

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC=CC=C2Br)CCN3C(C4=CC=CC5=C4C(=CC=C5)C3=O)O

Isomeric SMILES

C1CN(CCC1C2=CC=CC=C2Br)CCN3C(C4=CC=CC5=C4C(=CC=C5)C3=O)O

InChI

InChI=1S/C25H25BrN2O2/c26-22-10-2-1-7-19(22)17-11-13-27(14-12-17)15-16-28-24(29)20-8-3-5-18-6-4-9-21(23(18)20)25(28)30/h1-10,17,24,29H,11-16H2