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

Systemtic Name: 1-(4-fluorophenyl)-4-[4-(7-methoxyisoquinolin-3-yl)piperazin-1-yl]butan-1-one Openeye Name: 1-(4-fluorophenyl)-4-[4-(7-methoxy-3-isoquinolyl)piperazin-1-yl]butan-1-one CAS Name: 1-(4-fluorophenyl)-4-[4-(7-methoxy-3-isoquinolinyl)-1-piperazinyl]-1-butanone IUPAC Name: 1-(4-fluorophenyl)-4-[4-(7-methoxyisoquinolin-3-yl)piperazin-1-yl]butan-1-one Traditional Name: 1-(4-fluorophenyl)-4-[4-(7-methoxy-3-isoquinolyl)piperazino]butan-1-one Formula: C24H26FN3O2 MolecularWeight: 407.480543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CN=C(C=C2C=C1)N3CCN(CC3)CCCC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC2=CN=C(C=C2C=C1)N3CCN(CC3)CCCC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H26FN3O2/c1-30-22-9-6-19-16-24(26-17-20(19)15-22)28-13-11-27(12-14-28)10-2-3-23(29)18-4-7-21(25)8-5-18/h4-9,15-17H,2-3,10-14H2,1H3