2-[2-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]ethyl]-4H-isoquinoline-1,3-dione

Systemtic Name: 2-[2-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]ethyl]-4H-isoquinoline-1,3-dione Openeye Name: 2-[2-[4-(4-fluorobenzoyl)-1-piperidyl]ethyl]-4H-isoquinoline-1,3-dione CAS Name: 2-[2-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidinyl]ethyl]-4H-isoquinoline-1,3-dione IUPAC Name: 2-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-4H-isoquinoline-1,3-dione Traditional Name: 2-[2-[4-(4-fluorobenzoyl)piperidino]ethyl]-4H-isoquinoline-1,3-quinone Formula: C23H23FN2O3 MolecularWeight: 393.439457

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC=C(C=C2)F)CCN3C(=O)CC4=CC=CC=C4C3=O

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC=C(C=C2)F)CCN3C(=O)C4=CC=CC=C4C[11C]3=O

InChI

InChI=1S/C23H23FN2O3/c24-19-7-5-16(6-8-19)22(28)17-9-11-25(12-10-17)13-14-26-21(27)15-18-3-1-2-4-20(18)23(26)29/h1-8,17H,9-15H2/i21-1