4-[2-[2-fluoranyl-4-[(E)-6-oxidanylhept-1-enyl]phenyl]pyrimidin-5-yl]phenol

Systemtic Name: 4-[2-[2-fluoranyl-4-[(E)-6-oxidanylhept-1-enyl]phenyl]pyrimidin-5-yl]phenol Openeye Name: 4-[2-[2-fluoro-4-[(E)-6-hydroxyhept-1-enyl]phenyl]pyrimidin-5-yl]phenol CAS Name: 4-[2-[2-fluoro-4-[(E)-6-hydroxyhept-1-enyl]phenyl]-5-pyrimidinyl]phenol IUPAC Name: 4-[2-[2-fluoro-4-[(E)-6-hydroxyhept-1-enyl]phenyl]pyrimidin-5-yl]phenol Traditional Name: 4-[2-[2-fluoro-4-[(E)-6-hydroxyhept-1-enyl]phenyl]pyrimidin-5-yl]phenol Formula: C23H23FN2O2 MolecularWeight: 378.439323

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC=CC1=CC(=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)O)F)O

Isomeric SMILES

CC(CCC/C=C/C1=CC(=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)O)F)O

InChI

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