(4E)-2-fluoranyl-4-[5-(3-fluoranyl-4-octoxy-phenyl)-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-2-fluoranyl-4-[5-(3-fluoranyl-4-octoxy-phenyl)-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: (4E)-2-fluoro-4-[5-(3-fluoro-4-octoxy-phenyl)-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one CAS Name: (4E)-2-fluoro-4-[5-(3-fluoro-4-octoxyphenyl)-1H-pyrimidin-2-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-2-fluoro-4-[5-(3-fluoro-4-octoxyphenyl)-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: (4E)-2-fluoro-4-[5-(3-fluoro-4-octoxy-phenyl)-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Formula: C24H26F2N2O2 MolecularWeight: 412.472246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)C2=CNC(=C3C=CC(=O)C(=C3)F)N=C2)F

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)C2=CN/C(=C\3/C=CC(=O)C(=C3)F)/N=C2)F

InChI

InChI=1S/C24H26F2N2O2/c1-2-3-4-5-6-7-12-30-23-11-9-17(13-21(23)26)19-15-27-24(28-16-19)18-8-10-22(29)20(25)14-18/h8-11,13-16,27H,2-7,12H2,1H3/b24-18+