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

Systemtic Name: 4-[4-(7-chloranylisoquinolin-3-yl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one Openeye Name: 4-[4-(7-chloro-3-isoquinolyl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one CAS Name: 4-[4-(7-chloro-3-isoquinolinyl)-1-piperazinyl]-1-(4-fluorophenyl)-1-butanone IUPAC Name: 4-[4-(7-chloroisoquinolin-3-yl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one Traditional Name: 4-[4-(7-chloro-3-isoquinolyl)piperazino]-1-(4-fluorophenyl)butan-1-one Formula: C23H23ClFN3O MolecularWeight: 411.899623

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C23H23ClFN3O/c24-20-6-3-18-15-23(26-16-19(18)14-20)28-12-10-27(11-13-28)9-1-2-22(29)17-4-7-21(25)8-5-17/h3-8,14-16H,1-2,9-13H2