1-(4-ethylpiperazin-1-yl)-3-(2-phenylethynyl)isoquinoline dihydrochloride

Systemtic Name: 1-(4-ethylpiperazin-1-yl)-3-(2-phenylethynyl)isoquinoline dihydrochloride Openeye Name: 1-(4-ethylpiperazin-1-yl)-3-(2-phenylethynyl)isoquinoline dihydrochloride CAS Name: 1-(4-ethyl-1-piperazinyl)-3-(2-phenylethynyl)isoquinoline dihydrochloride IUPAC Name: 1-(4-ethylpiperazin-1-yl)-3-(2-phenylethynyl)isoquinoline dihydrochloride Traditional Name: 1-(4-ethylpiperazino)-3-(2-phenylethynyl)isoquinoline dihydrochloride Formula: C23H25Cl2N3 MolecularWeight: 414.3707

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C#CC4=CC=CC=C4.Cl.Cl

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C#CC4=CC=CC=C4.Cl.Cl

InChI

InChI=1S/C23H23N3.2ClH/c1-2-25-14-16-26(17-15-25)23-22-11-7-6-10-20(22)18-21(24-23)13-12-19-8-4-3-5-9-19;;/h3-11,18H,2,14-17H2,1H3;2*1H