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

Systemtic Name: 4-[6,7-bis(fluoranyl)-1,3-benzodioxol-5-yl]-7-chloranyl-2-[4-(trifluoromethyl)phenyl]phthalazin-1-one Openeye Name: 7-chloro-4-(6,7-difluoro-1,3-benzodioxol-5-yl)-2-[4-(trifluoromethyl)phenyl]phthalazin-1-one CAS Name: 7-chloro-4-(6,7-difluoro-1,3-benzodioxol-5-yl)-2-[4-(trifluoromethyl)phenyl]-1-phthalazinone IUPAC Name: 7-chloro-4-(6,7-difluoro-1,3-benzodioxol-5-yl)-2-[4-(trifluoromethyl)phenyl]phthalazin-1-one Traditional Name: 7-chloro-4-(6,7-difluoro-1,3-benzodioxol-5-yl)-2-[4-(trifluoromethyl)phenyl]phthalazin-1-one Formula: C22H10ClF5N2O3 MolecularWeight: 480.771416

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=C(C(=C2)C3=NN(C(=O)C4=C3C=CC(=C4)Cl)C5=CC=C(C=C5)C(F)(F)F)F)F

Isomeric SMILES

C1OC2=C(O1)C(=C(C(=C2)C3=NN(C(=O)C4=C3C=CC(=C4)Cl)C5=CC=C(C=C5)C(F)(F)F)F)F

InChI

InChI=1S/C22H10ClF5N2O3/c23-11-3-6-13-14(7-11)21(31)30(12-4-1-10(2-5-12)22(26,27)28)29-19(13)15-8-16-20(33-9-32-16)18(25)17(15)24/h1-8H,9H2