3-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]-6-phenyl-pyrimidin-4-one

Systemtic Name: 3-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]-6-phenyl-pyrimidin-4-one Openeye Name: 3-[2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl]-6-phenyl-pyrimidin-4-one CAS Name: 3-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-6-phenyl-4-pyrimidinone IUPAC Name: 3-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-6-phenylpyrimidin-4-one Traditional Name: 3-[2-(1,3-benzodioxol-5-yl)-2-keto-ethyl]-6-phenyl-pyrimidin-4-one Formula: C19H14N2O4 MolecularWeight: 334.32546

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)CN3C=NC(=CC3=O)C4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)CN3C=NC(=CC3=O)C4=CC=CC=C4

InChI

InChI=1S/C19H14N2O4/c22-16(14-6-7-17-18(8-14)25-12-24-17)10-21-11-20-15(9-19(21)23)13-4-2-1-3-5-13/h1-9,11H,10,12H2