4-[6,7-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-(4-fluorophenyl)phthalazin-1-one

Systemtic Name: 4-[6,7-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-(4-fluorophenyl)phthalazin-1-one Openeye Name: 4-(6,7-difluoro-1,3-benzodioxol-5-yl)-2-(4-fluorophenyl)phthalazin-1-one CAS Name: 4-(6,7-difluoro-1,3-benzodioxol-5-yl)-2-(4-fluorophenyl)-1-phthalazinone IUPAC Name: 4-(6,7-difluoro-1,3-benzodioxol-5-yl)-2-(4-fluorophenyl)phthalazin-1-one Traditional Name: 4-(6,7-difluoro-1,3-benzodioxol-5-yl)-2-(4-fluorophenyl)phthalazin-1-one Formula: C21H11F3N2O3 MolecularWeight: 396.31885

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=C(C(=C2)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=C(C=C5)F)F)F

Isomeric SMILES

C1OC2=C(O1)C(=C(C(=C2)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=C(C=C5)F)F)F

InChI

InChI=1S/C21H11F3N2O3/c22-11-5-7-12(8-6-11)26-21(27)14-4-2-1-3-13(14)19(25-26)15-9-16-20(29-10-28-16)18(24)17(15)23/h1-9H,10H2