1-(4-ethylpiperazin-1-yl)-3-[3-fluoranyl-4-(1-methoxyethoxy)phenyl]isoquinoline dihydrochloride

Systemtic Name: 1-(4-ethylpiperazin-1-yl)-3-[3-fluoranyl-4-(1-methoxyethoxy)phenyl]isoquinoline dihydrochloride Openeye Name: 1-(4-ethylpiperazin-1-yl)-3-[3-fluoro-4-(1-methoxyethoxy)phenyl]isoquinoline dihydrochloride CAS Name: 1-(4-ethyl-1-piperazinyl)-3-[3-fluoro-4-(1-methoxyethoxy)phenyl]isoquinoline dihydrochloride IUPAC Name: 1-(4-ethylpiperazin-1-yl)-3-[3-fluoro-4-(1-methoxyethoxy)phenyl]isoquinoline dihydrochloride Traditional Name: 1-(4-ethylpiperazino)-3-[3-fluoro-4-(1-methoxyethoxy)phenyl]isoquinoline dihydrochloride Formula: C24H30Cl2FN3O2 MolecularWeight: 482.418303

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC(=C(C=C4)OC(C)OC)F.Cl.Cl

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC(=C(C=C4)OC(C)OC)F.Cl.Cl

InChI

InChI=1S/C24H28FN3O2.2ClH/c1-4-27-11-13-28(14-12-27)24-20-8-6-5-7-18(20)16-22(26-24)19-9-10-23(21(25)15-19)30-17(2)29-3;;/h5-10,15-17H,4,11-14H2,1-3H3;2*1H