butyl 4-[2-fluoranyl-4-(4-pentylcyclohexyl)phenyl]benzoate

Systemtic Name: butyl 4-[2-fluoranyl-4-(4-pentylcyclohexyl)phenyl]benzoate Openeye Name: butyl 4-[2-fluoro-4-(4-pentylcyclohexyl)phenyl]benzoate CAS Name: 4-[2-fluoro-4-(4-pentylcyclohexyl)phenyl]benzoic acid butyl ester IUPAC Name: butyl 4-[2-fluoro-4-(4-pentylcyclohexyl)phenyl]benzoate Traditional Name: 4-[4-(4-amylcyclohexyl)-2-fluoro-phenyl]benzoic acid butyl ester Formula: C28H37FO2 MolecularWeight: 424.590583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=CC(=C(C=C2)C3=CC=C(C=C3)C(=O)OCCCC)F

Isomeric SMILES

CCCCCC1CCC(CC1)C2=CC(=C(C=C2)C3=CC=C(C=C3)C(=O)OCCCC)F

InChI

InChI=1S/C28H37FO2/c1-3-5-7-8-21-9-11-22(12-10-21)25-17-18-26(27(29)20-25)23-13-15-24(16-14-23)28(30)31-19-6-4-2/h13-18,20-22H,3-12,19H2,1-2H3