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[2-(4-propylphenyl)pyrimidin-5-yl] 2-fluoranyl-4-octoxy-benzoate

[2-(4-propylphenyl)pyrimidin-5-yl] 2-fluoranyl-4-octoxy-benzoate

Systemtic Name:[2-(4-propylphenyl)pyrimidin-5-yl] 2-fluoranyl-4-octoxy-benzoate
Openeye Name:[2-(4-propylphenyl)pyrimidin-5-yl] 2-fluoro-4-octoxy-benzoate
CAS Name:2-fluoro-4-octoxybenzoic acid [2-(4-propylphenyl)-5-pyrimidinyl] ester
IUPAC Name:[2-(4-propylphenyl)pyrimidin-5-yl] 2-fluoro-4-octoxybenzoate
Traditional Name:2-fluoro-4-octoxy-benzoic acid [2-(4-propylphenyl)pyrimidin-5-yl] ester
Formula: C28H33FN2O3
MolecularWeight: 464.571623
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC(=C(C=C1)C(=O)OC2=CN=C(N=C2)C3=CC=C(C=C3)CCC)F


Isomeric SMILES

CCCCCCCCOC1=CC(=C(C=C1)C(=O)OC2=CN=C(N=C2)C3=CC=C(C=C3)CCC)F


InChI

InChI=1S/C28H33FN2O3/c1-3-5-6-7-8-9-17-33-23-15-16-25(26(29)18-23)28(32)34-24-19-30-27(31-20-24)22-13-11-21(10-4-2)12-14-22/h11-16,18-20H,3-10,17H2,1-2H3


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