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[3-fluoranyl-4-(5-octylpyrimidin-2-yl)phenyl] 4-nonylbenzoate

[3-fluoranyl-4-(5-octylpyrimidin-2-yl)phenyl] 4-nonylbenzoate

Systemtic Name:[3-fluoranyl-4-(5-octylpyrimidin-2-yl)phenyl] 4-nonylbenzoate
Openeye Name:[3-fluoro-4-(5-octylpyrimidin-2-yl)phenyl] 4-nonylbenzoate
CAS Name:4-nonylbenzoic acid [3-fluoro-4-(5-octyl-2-pyrimidinyl)phenyl] ester
IUPAC Name:[3-fluoro-4-(5-octylpyrimidin-2-yl)phenyl] 4-nonylbenzoate
Traditional Name:4-nonylbenzoic acid [3-fluoro-4-(5-octylpyrimidin-2-yl)phenyl] ester
Formula: C34H45FN2O2
MolecularWeight: 532.731703
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC(=C(C=C2)C3=NC=C(C=N3)CCCCCCCC)F


Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC(=C(C=C2)C3=NC=C(C=N3)CCCCCCCC)F


InChI

InChI=1S/C34H45FN2O2/c1-3-5-7-9-11-13-14-16-27-18-20-29(21-19-27)34(38)39-30-22-23-31(32(35)24-30)33-36-25-28(26-37-33)17-15-12-10-8-6-4-2/h18-26H,3-17H2,1-2H3


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