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

Systemtic Name: 2-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-3-oxidanyl-3H-benzo[de]isoquinolin-1-one Openeye Name: 3-hydroxy-2-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-3H-benzo[de]isoquinolin-1-one CAS Name: 3-hydroxy-2-[2-[4-(4-methoxyphenyl)-1-piperazinyl]ethyl]-3H-benzo[de]isoquinolin-1-one IUPAC Name: 3-hydroxy-2-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-3H-benzo[de]isoquinolin-1-one Traditional Name: 3-hydroxy-2-[2-[4-(4-methoxyphenyl)piperazino]ethyl]-3H-benzo[de]isoquinolin-1-one Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CCN3C(C4=CC=CC5=C4C(=CC=C5)C3=O)O

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CCN3C(C4=CC=CC5=C4C(=CC=C5)C3=O)O

InChI

InChI=1S/C25H27N3O3/c1-31-20-10-8-19(9-11-20)27-15-12-26(13-16-27)14-17-28-24(29)21-6-2-4-18-5-3-7-22(23(18)21)25(28)30/h2-11,24,29H,12-17H2,1H3