2-[4-[1-(4-ethylpiperazin-1-yl)-8-fluoranyl-isoquinolin-3-yl]phenoxy]ethanol dihydrochloride

Systemtic Name: 2-[4-[1-(4-ethylpiperazin-1-yl)-8-fluoranyl-isoquinolin-3-yl]phenoxy]ethanol dihydrochloride Openeye Name: 2-[4-[1-(4-ethylpiperazin-1-yl)-8-fluoro-3-isoquinolyl]phenoxy]ethanol dihydrochloride CAS Name: 2-[4-[1-(4-ethyl-1-piperazinyl)-8-fluoro-3-isoquinolinyl]phenoxy]ethanol dihydrochloride IUPAC Name: 2-[4-[1-(4-ethylpiperazin-1-yl)-8-fluoroisoquinolin-3-yl]phenoxy]ethanol dihydrochloride Traditional Name: 2-[4-[1-(4-ethylpiperazino)-8-fluoro-3-isoquinolyl]phenoxy]ethanol dihydrochloride Formula: C23H28Cl2FN3O2 MolecularWeight: 468.391723

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C3C(=CC(=N2)C4=CC=C(C=C4)OCCO)C=CC=C3F.Cl.Cl

Isomeric SMILES

CCN1CCN(CC1)C2=C3C(=CC(=N2)C4=CC=C(C=C4)OCCO)C=CC=C3F.Cl.Cl

InChI

InChI=1S/C23H26FN3O2.2ClH/c1-2-26-10-12-27(13-11-26)23-22-18(4-3-5-20(22)24)16-21(25-23)17-6-8-19(9-7-17)29-15-14-28;;/h3-9,16,28H,2,10-15H2,1H3;2*1H