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

Systemtic Name: 2-[2-[3-(4-chlorophenyl)piperidin-1-yl]ethyl]-3-oxidanyl-3H-benzo[de]isoquinolin-1-one Openeye Name: 2-[2-[3-(4-chlorophenyl)-1-piperidyl]ethyl]-3-hydroxy-3H-benzo[de]isoquinolin-1-one CAS Name: 2-[2-[3-(4-chlorophenyl)-1-piperidinyl]ethyl]-3-hydroxy-3H-benzo[de]isoquinolin-1-one IUPAC Name: 2-[2-[3-(4-chlorophenyl)piperidin-1-yl]ethyl]-3-hydroxy-3H-benzo[de]isoquinolin-1-one Traditional Name: 2-[2-[3-(4-chlorophenyl)piperidino]ethyl]-3-hydroxy-3H-benzo[de]isoquinolin-1-one Formula: C25H25ClN2O2 MolecularWeight: 420.9312

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCN2C(C3=CC=CC4=C3C(=CC=C4)C2=O)O)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CC(CN(C1)CCN2C(C3=CC=CC4=C3C(=CC=C4)C2=O)O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H25ClN2O2/c26-20-11-9-17(10-12-20)19-6-3-13-27(16-19)14-15-28-24(29)21-7-1-4-18-5-2-8-22(23(18)21)25(28)30/h1-2,4-5,7-12,19,24,29H,3,6,13-16H2