4-[4-(7-fluoranylisoquinolin-3-yl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one

Systemtic Name: 4-[4-(7-fluoranylisoquinolin-3-yl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one Openeye Name: 4-[4-(7-fluoro-3-isoquinolyl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one CAS Name: 4-[4-(7-fluoro-3-isoquinolinyl)-1-piperazinyl]-1-(4-fluorophenyl)-1-butanone IUPAC Name: 4-[4-(7-fluoroisoquinolin-3-yl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one Traditional Name: 4-[4-(7-fluoro-3-isoquinolyl)piperazino]-1-(4-fluorophenyl)butan-1-one Formula: C23H23F2N3O MolecularWeight: 395.445026

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC(=O)C2=CC=C(C=C2)F)C3=NC=C4C=C(C=CC4=C3)F

Isomeric SMILES

C1CN(CCN1CCCC(=O)C2=CC=C(C=C2)F)C3=NC=C4C=C(C=CC4=C3)F

InChI

InChI=1S/C23H23F2N3O/c24-20-6-3-17(4-7-20)22(29)2-1-9-27-10-12-28(13-11-27)23-15-18-5-8-21(25)14-19(18)16-26-23/h3-8,14-16H,1-2,9-13H2