N-[(E)-1-[2,4-bis(fluoranyl)phenyl]ethylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[(E)-1-[2,4-bis(fluoranyl)phenyl]ethylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[(E)-1-(2,4-difluorophenyl)ethylideneamino]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[(E)-1-(2,4-difluorophenyl)ethylideneamino]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[(E)-1-(2,4-difluorophenyl)ethylideneamino]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[(E)-1-(2,4-difluorophenyl)ethylideneamino]-4-keto-3H-phthalazine-1-carboxamide Formula: C17H12F2N4O2 MolecularWeight: 342.299586

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NNC(=O)C2=CC=CC=C21)C3=C(C=C(C=C3)F)F

Isomeric SMILES

C/C(=N\NC(=O)C1=NNC(=O)C2=CC=CC=C21)/C3=C(C=C(C=C3)F)F

InChI

InChI=1S/C17H12F2N4O2/c1-9(11-7-6-10(18)8-14(11)19)20-23-17(25)15-12-4-2-3-5-13(12)16(24)22-21-15/h2-8H,1H3,(H,22,24)(H,23,25)/b20-9+