2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-ethoxy-pyrimidine dihydrochloride

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-ethoxy-pyrimidine dihydrochloride Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-ethoxy-pyrimidine dihydrochloride CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-4-ethoxypyrimidine dihydrochloride IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-ethoxypyrimidine dihydrochloride Traditional Name: 4-ethoxy-2-(4-piperonylpiperazino)pyrimidine dihydrochloride Formula: C18H24Cl2N4O3 MolecularWeight: 415.31416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC=C1)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4.Cl.Cl

Isomeric SMILES

CCOC1=NC(=NC=C1)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4.Cl.Cl

InChI

InChI=1S/C18H22N4O3.2ClH/c1-2-23-17-5-6-19-18(20-17)22-9-7-21(8-10-22)12-14-3-4-15-16(11-14)25-13-24-15;;/h3-6,11H,2,7-10,12-13H2,1H3;2*1H