3-[4-(4-fluorophenyl)piperazin-1-yl]-2H-isoquinolin-1-one

Systemtic Name: 3-[4-(4-fluorophenyl)piperazin-1-yl]-2H-isoquinolin-1-one Openeye Name: 3-[4-(4-fluorophenyl)piperazin-1-yl]-2H-isoquinolin-1-one CAS Name: 3-[4-(4-fluorophenyl)-1-piperazinyl]-2H-isoquinolin-1-one IUPAC Name: 3-[4-(4-fluorophenyl)piperazin-1-yl]-2H-isoquinolin-1-one Traditional Name: 3-[4-(4-fluorophenyl)piperazino]isocarbostyril Formula: C19H18FN3O MolecularWeight: 323.364123

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C3=CC4=CC=CC=C4C(=O)N3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C3=CC4=CC=CC=C4C(=O)N3

InChI

InChI=1S/C19H18FN3O/c20-15-5-7-16(8-6-15)22-9-11-23(12-10-22)18-13-14-3-1-2-4-17(14)19(24)21-18/h1-8,13H,9-12H2,(H,21,24)