1-cyclohexyl-4-pentyl-cyclohexane; (2-fluoranyl-4-pentyl-phenyl) hydrogen carbonate

Systemtic Name: 1-cyclohexyl-4-pentyl-cyclohexane; (2-fluoranyl-4-pentyl-phenyl) hydrogen carbonate Openeye Name: 1-cyclohexyl-4-pentyl-cyclohexane; (2-fluoro-4-pentyl-phenyl) hydrogen carbonate CAS Name: carbonic acid (2-fluoro-4-pentylphenyl) ester; 1-cyclohexyl-4-pentylcyclohexane IUPAC Name: 1-cyclohexyl-4-pentylcyclohexane; (2-fluoro-4-pentylphenyl) hydrogen carbonate Traditional Name: 1-amyl-4-cyclohexyl-cyclohexane; carbonic acid (4-amyl-2-fluoro-phenyl) ester Formula: C29H47FO3 MolecularWeight: 462.680083

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2CCCCC2.CCCCCC1=CC(=C(C=C1)OC(=O)O)F

Isomeric SMILES

CCCCCC1CCC(CC1)C2CCCCC2.CCCCCC1=CC(=C(C=C1)OC(=O)O)F

InChI

InChI=1S/C17H32.C12H15FO3/c1-2-3-5-8-15-11-13-17(14-12-15)16-9-6-4-7-10-16;1-2-3-4-5-9-6-7-11(10(13)8-9)16-12(14)15/h15-17H,2-14H2,1H3;6-8H,2-5H2,1H3,(H,14,15)