(2-fluoranyl-4-pentyl-phenyl) 1-cyclooctyl-4-pentyl-cyclooctane-1-carboxylate

Systemtic Name: (2-fluoranyl-4-pentyl-phenyl) 1-cyclooctyl-4-pentyl-cyclooctane-1-carboxylate Openeye Name: (2-fluoro-4-pentyl-phenyl) 1-cyclooctyl-4-pentyl-cyclooctanecarboxylate CAS Name: 1-cyclooctyl-4-pentyl-1-cyclooctanecarboxylic acid (2-fluoro-4-pentylphenyl) ester IUPAC Name: (2-fluoro-4-pentylphenyl) 1-cyclooctyl-4-pentylcyclooctane-1-carboxylate Traditional Name: 4-amyl-1-cyclooctyl-cyclooctanecarboxylic acid (4-amyl-2-fluoro-phenyl) ester Formula: C33H53FO2 MolecularWeight: 500.771123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCCCC(CC1)(C2CCCCCCC2)C(=O)OC3=C(C=C(C=C3)CCCCC)F

Isomeric SMILES

CCCCCC1CCCCC(CC1)(C2CCCCCCC2)C(=O)OC3=C(C=C(C=C3)CCCCC)F

InChI

InChI=1S/C33H53FO2/c1-3-5-10-16-27-17-14-15-24-33(25-23-27,29-19-12-8-7-9-13-20-29)32(35)36-31-22-21-28(26-30(31)34)18-11-6-4-2/h21-22,26-27,29H,3-20,23-25H2,1-2H3