4-[5-[2-fluoranyl-4-[(E)-6-oxidanylhept-1-enyl]phenyl]-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[5-[2-fluoranyl-4-[(E)-6-oxidanylhept-1-enyl]phenyl]-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[5-[2-fluoro-4-[(E)-6-hydroxyhept-1-enyl]phenyl]-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[5-[2-fluoro-4-[(E)-6-hydroxyhept-1-enyl]phenyl]-1H-pyrimidin-2-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[5-[2-fluoro-4-[(E)-6-hydroxyhept-1-enyl]phenyl]-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[5-[2-fluoro-4-[(E)-6-hydroxyhept-1-enyl]phenyl]-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Formula: C23H23FN2O2 MolecularWeight: 378.439323

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC=CC1=CC(=C(C=C1)C2=CNC(=C3C=CC(=O)C=C3)N=C2)F)O

Isomeric SMILES

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

InChI

InChI=1S/C23H23FN2O2/c1-16(27)5-3-2-4-6-17-7-12-21(22(24)13-17)19-14-25-23(26-15-19)18-8-10-20(28)11-9-18/h4,6-16,25,27H,2-3,5H2,1H3/b6-4+