3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[4-(2-pyrimidyl)piperazino]propan-1-one Formula: C19H22N4O3 MolecularWeight: 354.40298

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CCC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CCC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C19H22N4O3/c24-18(5-3-15-2-4-16-17(14-15)26-13-12-25-16)22-8-10-23(11-9-22)19-20-6-1-7-21-19/h1-2,4,6-7,14H,3,5,8-13H2