2-[4-[5-(4-chloranylphenoxy)-2-piperidin-1-yl-pyrimidin-4-yl]piperazin-1-yl]ethanol dihydrochloride

Systemtic Name: 2-[4-[5-(4-chloranylphenoxy)-2-piperidin-1-yl-pyrimidin-4-yl]piperazin-1-yl]ethanol dihydrochloride Openeye Name: 2-[4-[5-(4-chlorophenoxy)-2-(1-piperidyl)pyrimidin-4-yl]piperazin-1-yl]ethanol dihydrochloride CAS Name: 2-[4-[5-(4-chlorophenoxy)-2-(1-piperidinyl)-4-pyrimidinyl]-1-piperazinyl]ethanol dihydrochloride IUPAC Name: 2-[4-[5-(4-chlorophenoxy)-2-piperidin-1-ylpyrimidin-4-yl]piperazin-1-yl]ethanol dihydrochloride Traditional Name: 2-[4-[5-(4-chlorophenoxy)-2-piperidino-pyrimidin-4-yl]piperazino]ethanol dihydrochloride Formula: C21H30Cl3N5O2 MolecularWeight: 490.8542

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC=C(C(=N2)N3CCN(CC3)CCO)OC4=CC=C(C=C4)Cl.Cl.Cl

Isomeric SMILES

C1CCN(CC1)C2=NC=C(C(=N2)N3CCN(CC3)CCO)OC4=CC=C(C=C4)Cl.Cl.Cl

InChI

InChI=1S/C21H28ClN5O2.2ClH/c22-17-4-6-18(7-5-17)29-19-16-23-21(27-8-2-1-3-9-27)24-20(19)26-12-10-25(11-13-26)14-15-28;;/h4-7,16,28H,1-3,8-15H2;2*1H