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

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4,5-dimethyl-pyrimidine hydrochloride Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4,5-dimethyl-pyrimidine hydrochloride CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-4,5-dimethylpyrimidine hydrochloride IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4,5-dimethylpyrimidine hydrochloride Traditional Name: 4,5-dimethyl-2-(4-piperonylpiperazino)pyrimidine hydrochloride Formula: C18H23ClN4O2 MolecularWeight: 362.85382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1C)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4.Cl

Isomeric SMILES

CC1=CN=C(N=C1C)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4.Cl

InChI

InChI=1S/C18H22N4O2.ClH/c1-13-10-19-18(20-14(13)2)22-7-5-21(6-8-22)11-15-3-4-16-17(9-15)24-12-23-16;/h3-4,9-10H,5-8,11-12H2,1-2H3;1H