[4-(3-nonyl-4H-pyrimidin-2-yl)phenyl] 4-(8-fluoranyloctoxy)benzoate

Systemtic Name: [4-(3-nonyl-4H-pyrimidin-2-yl)phenyl] 4-(8-fluoranyloctoxy)benzoate Openeye Name: [4-(3-nonyl-4H-pyrimidin-2-yl)phenyl] 4-(8-fluorooctoxy)benzoate CAS Name: 4-(8-fluorooctoxy)benzoic acid [4-(3-nonyl-4H-pyrimidin-2-yl)phenyl] ester IUPAC Name: [4-(3-nonyl-4H-pyrimidin-2-yl)phenyl] 4-(8-fluorooctoxy)benzoate Traditional Name: 4-(8-fluorooctoxy)benzoic acid [4-(3-nonyl-4H-pyrimidin-2-yl)phenyl] ester Formula: C34H47FN2O3 MolecularWeight: 550.746983

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCN1CC=CN=C1C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OCCCCCCCCF

Isomeric SMILES

CCCCCCCCCN1CC=CN=C1C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OCCCCCCCCF

InChI

InChI=1S/C34H47FN2O3/c1-2-3-4-5-7-10-13-26-37-27-15-25-36-33(37)29-16-22-32(23-17-29)40-34(38)30-18-20-31(21-19-30)39-28-14-11-8-6-9-12-24-35/h15-23,25H,2-14,24,26-28H2,1H3