1-(4-ethylpiperazin-1-yl)-6-fluoranyl-3-(4-methoxyphenyl)isoquinoline dihydrochloride

Systemtic Name: 1-(4-ethylpiperazin-1-yl)-6-fluoranyl-3-(4-methoxyphenyl)isoquinoline dihydrochloride Openeye Name: 1-(4-ethylpiperazin-1-yl)-6-fluoro-3-(4-methoxyphenyl)isoquinoline dihydrochloride CAS Name: 1-(4-ethyl-1-piperazinyl)-6-fluoro-3-(4-methoxyphenyl)isoquinoline dihydrochloride IUPAC Name: 1-(4-ethylpiperazin-1-yl)-6-fluoro-3-(4-methoxyphenyl)isoquinoline dihydrochloride Traditional Name: 1-(4-ethylpiperazino)-6-fluoro-3-(4-methoxyphenyl)isoquinoline dihydrochloride Formula: C22H26Cl2FN3O MolecularWeight: 438.365743

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C3C=CC(=CC3=CC(=N2)C4=CC=C(C=C4)OC)F.Cl.Cl

Isomeric SMILES

CCN1CCN(CC1)C2=C3C=CC(=CC3=CC(=N2)C4=CC=C(C=C4)OC)F.Cl.Cl

InChI

InChI=1S/C22H24FN3O.2ClH/c1-3-25-10-12-26(13-11-25)22-20-9-6-18(23)14-17(20)15-21(24-22)16-4-7-19(27-2)8-5-16;;/h4-9,14-15H,3,10-13H2,1-2H3;2*1H