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

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-2-methyl-piperazin-1-yl]pyrimidine Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-2-methyl-piperazin-1-yl]pyrimidine CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-2-methyl-1-piperazinyl]pyrimidine IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-2-methylpiperazin-1-yl]pyrimidine Traditional Name: 2-(2-methyl-4-piperonyl-piperazino)pyrimidine Formula: C17H20N4O2 MolecularWeight: 312.3663

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=NC=CC=N2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1CN(CCN1C2=NC=CC=N2)CC3=CC4=C(C=C3)OCO4

InChI

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