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

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-3-methyl-piperazin-1-yl]pyrimidine hydrochloride Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-3-methyl-piperazin-1-yl]pyrimidine hydrochloride CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-3-methyl-1-piperazinyl]pyrimidine hydrochloride IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-3-methylpiperazin-1-yl]pyrimidine hydrochloride Traditional Name: 2-(3-methyl-4-piperonyl-piperazino)pyrimidine hydrochloride Formula: C17H21ClN4O2 MolecularWeight: 348.82724

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1CC2=CC3=C(C=C2)OCO3)C4=NC=CC=N4.Cl

Isomeric SMILES

CC1CN(CCN1CC2=CC3=C(C=C2)OCO3)C4=NC=CC=N4.Cl

InChI

InChI=1S/C17H20N4O2.ClH/c1-13-10-21(17-18-5-2-6-19-17)8-7-20(13)11-14-3-4-15-16(9-14)23-12-22-15;/h2-6,9,13H,7-8,10-12H2,1H3;1H