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

Systemtic Name: 3-oxidanyl-2-[2-[3-(3-phenylpropyl)piperidin-1-yl]ethyl]-3H-benzo[de]isoquinolin-1-one Openeye Name: 3-hydroxy-2-[2-[3-(3-phenylpropyl)-1-piperidyl]ethyl]-3H-benzo[de]isoquinolin-1-one CAS Name: 3-hydroxy-2-[2-[3-(3-phenylpropyl)-1-piperidinyl]ethyl]-3H-benzo[de]isoquinolin-1-one IUPAC Name: 3-hydroxy-2-[2-[3-(3-phenylpropyl)piperidin-1-yl]ethyl]-3H-benzo[de]isoquinolin-1-one Traditional Name: 3-hydroxy-2-[2-[3-(3-phenylpropyl)piperidino]ethyl]-3H-benzo[de]isoquinolin-1-one Formula: C28H32N2O2 MolecularWeight: 428.56588

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCN2C(C3=CC=CC4=C3C(=CC=C4)C2=O)O)CCCC5=CC=CC=C5

Isomeric SMILES

C1CC(CN(C1)CCN2C(C3=CC=CC4=C3C(=CC=C4)C2=O)O)CCCC5=CC=CC=C5

InChI

InChI=1S/C28H32N2O2/c31-27-24-15-5-13-23-14-6-16-25(26(23)24)28(32)30(27)19-18-29-17-7-12-22(20-29)11-4-10-21-8-2-1-3-9-21/h1-3,5-6,8-9,13-16,22,27,31H,4,7,10-12,17-20H2