(2-fluoranyl-4-pentyl-phenyl) 4-propylcyclohexane-1-carboxylate

Systemtic Name: (2-fluoranyl-4-pentyl-phenyl) 4-propylcyclohexane-1-carboxylate Openeye Name: (2-fluoro-4-pentyl-phenyl) 4-propylcyclohexanecarboxylate CAS Name: 4-propyl-1-cyclohexanecarboxylic acid (2-fluoro-4-pentylphenyl) ester IUPAC Name: (2-fluoro-4-pentylphenyl) 4-propylcyclohexane-1-carboxylate Traditional Name: 4-propylcyclohexanecarboxylic acid (4-amyl-2-fluoro-phenyl) ester Formula: C21H31FO2 MolecularWeight: 334.468043

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C=C1)OC(=O)C2CCC(CC2)CCC)F

Isomeric SMILES

CCCCCC1=CC(=C(C=C1)OC(=O)C2CCC(CC2)CCC)F

InChI

InChI=1S/C21H31FO2/c1-3-5-6-8-17-11-14-20(19(22)15-17)24-21(23)18-12-9-16(7-4-2)10-13-18/h11,14-16,18H,3-10,12-13H2,1-2H3