[2-fluoranyl-4-(5-undecylpyrimidin-2-yl)phenyl] 5-pentylfuran-2-carboxylate

Systemtic Name: [2-fluoranyl-4-(5-undecylpyrimidin-2-yl)phenyl] 5-pentylfuran-2-carboxylate Openeye Name: [2-fluoro-4-(5-undecylpyrimidin-2-yl)phenyl] 5-pentylfuran-2-carboxylate CAS Name: 5-pentyl-2-furancarboxylic acid [2-fluoro-4-(5-undecyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [2-fluoro-4-(5-undecylpyrimidin-2-yl)phenyl] 5-pentylfuran-2-carboxylate Traditional Name: 5-amylfuran-2-carboxylic acid [2-fluoro-4-(5-undecylpyrimidin-2-yl)phenyl] ester Formula: C31H41FN2O3 MolecularWeight: 508.667243

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)OC(=O)C3=CC=C(O3)CCCCC)F

Isomeric SMILES

CCCCCCCCCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)OC(=O)C3=CC=C(O3)CCCCC)F

InChI

InChI=1S/C31H41FN2O3/c1-3-5-7-8-9-10-11-12-14-15-24-22-33-30(34-23-24)25-17-19-28(27(32)21-25)37-31(35)29-20-18-26(36-29)16-13-6-4-2/h17-23H,3-16H2,1-2H3