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

Systemtic Name: 2-[1-(1,3-benzodioxol-5-ylmethyl)piperazin-2-yl]pyrimidine Openeye Name: 2-[1-(1,3-benzodioxol-5-ylmethyl)piperazin-2-yl]pyrimidine CAS Name: 2-[1-(1,3-benzodioxol-5-ylmethyl)-2-piperazinyl]pyrimidine IUPAC Name: 2-[1-(1,3-benzodioxol-5-ylmethyl)piperazin-2-yl]pyrimidine Traditional Name: 2-(1-piperonylpiperazin-2-yl)pyrimidine Formula: C16H18N4O2 MolecularWeight: 298.33972

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1)C2=NC=CC=N2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(C(CN1)C2=NC=CC=N2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C16H18N4O2/c1-4-18-16(19-5-1)13-9-17-6-7-20(13)10-12-2-3-14-15(8-12)22-11-21-14/h1-5,8,13,17H,6-7,9-11H2