1-(4-ethylpiperazin-1-yl)-3-[6-(4-methoxypiperidin-1-yl)pyridin-3-yl]isoquinoline trihydrochloride

Systemtic Name: 1-(4-ethylpiperazin-1-yl)-3-[6-(4-methoxypiperidin-1-yl)pyridin-3-yl]isoquinoline trihydrochloride Openeye Name: 1-(4-ethylpiperazin-1-yl)-3-[6-(4-methoxy-1-piperidyl)-3-pyridyl]isoquinoline trihydrochloride CAS Name: 1-(4-ethyl-1-piperazinyl)-3-[6-(4-methoxy-1-piperidinyl)-3-pyridinyl]isoquinoline trihydrochloride IUPAC Name: 1-(4-ethylpiperazin-1-yl)-3-[6-(4-methoxypiperidin-1-yl)pyridin-3-yl]isoquinoline trihydrochloride Traditional Name: 1-(4-ethylpiperazino)-3-[6-(4-methoxypiperidino)-3-pyridyl]isoquinoline trihydrochloride Formula: C26H36Cl3N5O MolecularWeight: 540.95594

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CN=C(C=C4)N5CCC(CC5)OC.Cl.Cl.Cl

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CN=C(C=C4)N5CCC(CC5)OC.Cl.Cl.Cl

InChI

InChI=1S/C26H33N5O.3ClH/c1-3-29-14-16-31(17-15-29)26-23-7-5-4-6-20(23)18-24(28-26)21-8-9-25(27-19-21)30-12-10-22(32-2)11-13-30;;;/h4-9,18-19,22H,3,10-17H2,1-2H3;3*1H