(4E)-2,3-bis(fluoranyl)-4-(5-octyl-1H-pyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-2,3-bis(fluoranyl)-4-(5-octyl-1H-pyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: (4E)-2,3-difluoro-4-(5-octyl-1H-pyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one CAS Name: (4E)-2,3-difluoro-4-(5-octyl-1H-pyrimidin-2-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-2,3-difluoro-4-(5-octyl-1H-pyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: (4E)-2,3-difluoro-4-(5-octyl-1H-pyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one Formula: C18H22F2N2O MolecularWeight: 320.376886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CNC(=C2C=CC(=O)C(=C2F)F)N=C1

Isomeric SMILES

CCCCCCCCC1=CN/C(=C\2/C=CC(=O)C(=C2F)F)/N=C1

InChI

InChI=1S/C18H22F2N2O/c1-2-3-4-5-6-7-8-13-11-21-18(22-12-13)14-9-10-15(23)17(20)16(14)19/h9-12,21H,2-8H2,1H3/b18-14+