3-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-2-fluoranyl-phenyl]propan-1-ol

Systemtic Name: 3-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-2-fluoranyl-phenyl]propan-1-ol Openeye Name: 3-[4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]-2-fluoro-phenyl]propan-1-ol CAS Name: 3-[4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]-2-fluorophenyl]-1-propanol IUPAC Name: 3-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-2-fluorophenyl]propan-1-ol Traditional Name: 3-[4-[1-(4-ethylpiperazino)-3-isoquinolyl]-2-fluoro-phenyl]propan-1-ol Formula: C24H28FN3O MolecularWeight: 393.497023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC(=C(C=C4)CCCO)F

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC(=C(C=C4)CCCO)F

InChI

InChI=1S/C24H28FN3O/c1-2-27-11-13-28(14-12-27)24-21-8-4-3-6-19(21)17-23(26-24)20-10-9-18(7-5-15-29)22(25)16-20/h3-4,6,8-10,16-17,29H,2,5,7,11-15H2,1H3