2-[2-[(3-fluorophenyl)amino]ethyl]-6-piperidin-1-yl-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[2-[(3-fluorophenyl)amino]ethyl]-6-piperidin-1-yl-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-[2-(3-fluoroanilino)ethyl]-6-(1-piperidyl)benzo[de]isoquinoline-1,3-dione CAS Name: 2-[2-(3-fluoroanilino)ethyl]-6-(1-piperidinyl)benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-[2-(3-fluoroanilino)ethyl]-6-piperidin-1-ylbenzo[de]isoquinoline-1,3-dione Traditional Name: 2-[2-(3-fluoroanilino)ethyl]-6-piperidino-benzo[de]isoquinoline-1,3-quinone Formula: C25H24FN3O2 MolecularWeight: 417.475363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C3C=CC=C4C3=C(C=C2)C(=O)N(C4=O)CCNC5=CC(=CC=C5)F

Isomeric SMILES

C1CCN(CC1)C2=C3C=CC=C4C3=C(C=C2)C(=O)N(C4=O)CCNC5=CC(=CC=C5)F

InChI

InChI=1S/C25H24FN3O2/c26-17-6-4-7-18(16-17)27-12-15-29-24(30)20-9-5-8-19-22(28-13-2-1-3-14-28)11-10-21(23(19)20)25(29)31/h4-11,16,27H,1-3,12-15H2