(4-nonylcyclohexyl) 2-fluoranyl-4-(5-nonylpyrimidin-2-yl)benzoate

Systemtic Name: (4-nonylcyclohexyl) 2-fluoranyl-4-(5-nonylpyrimidin-2-yl)benzoate Openeye Name: (4-nonylcyclohexyl) 2-fluoro-4-(5-nonylpyrimidin-2-yl)benzoate CAS Name: 2-fluoro-4-(5-nonyl-2-pyrimidinyl)benzoic acid (4-nonylcyclohexyl) ester IUPAC Name: (4-nonylcyclohexyl) 2-fluoro-4-(5-nonylpyrimidin-2-yl)benzoate Traditional Name: 2-fluoro-4-(5-nonylpyrimidin-2-yl)benzoic acid (4-nonylcyclohexyl) ester Formula: C35H53FN2O2 MolecularWeight: 552.805923

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1CCC(CC1)OC(=O)C2=C(C=C(C=C2)C3=NC=C(C=N3)CCCCCCCCC)F

Isomeric SMILES

CCCCCCCCCC1CCC(CC1)OC(=O)C2=C(C=C(C=C2)C3=NC=C(C=N3)CCCCCCCCC)F

InChI

InChI=1S/C35H53FN2O2/c1-3-5-7-9-11-13-15-17-28-19-22-31(23-20-28)40-35(39)32-24-21-30(25-33(32)36)34-37-26-29(27-38-34)18-16-14-12-10-8-6-4-2/h21,24-28,31H,3-20,22-23H2,1-2H3