1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-[4-(4-fluorophenyl)piperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-[4-(4-fluorophenyl)piperazin-1-yl]butane-1,4-dione Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-[4-(4-fluorophenyl)piperazin-1-yl]butane-1,4-dione CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-[4-(4-fluorophenyl)-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-[4-(4-fluorophenyl)piperazin-1-yl]butane-1,4-dione Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-[4-(4-fluorophenyl)piperazino]butane-1,4-dione Formula: C23H26FN3O2 MolecularWeight: 395.469843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CCC(=O)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CCC(=O)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H26FN3O2/c24-20-5-7-21(8-6-20)25-13-15-26(16-14-25)22(28)9-10-23(29)27-12-11-18-3-1-2-4-19(18)17-27/h1-8H,9-17H2