2-(1,3-benzodioxol-5-ylmethylamino)-1H-pyrimidin-6-one

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylamino)-1H-pyrimidin-6-one Openeye Name: 2-(1,3-benzodioxol-5-ylmethylamino)-1H-pyrimidin-6-one CAS Name: 2-(1,3-benzodioxol-5-ylmethylamino)-1H-pyrimidin-6-one IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylamino)-1H-pyrimidin-6-one Traditional Name: 2-(piperonylamino)-1H-pyrimidin-6-one Formula: C12H11N3O3 MolecularWeight: 245.23404

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=NC=CC(=O)N3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=NC=CC(=O)N3

InChI

InChI=1S/C12H11N3O3/c16-11-3-4-13-12(15-11)14-6-8-1-2-9-10(5-8)18-7-17-9/h1-5H,6-7H2,(H2,13,14,15,16)