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

Systemtic Name: pentyl 4-[2-fluoranyl-4-(4-pentylcyclohexyl)phenyl]benzoate Openeye Name: pentyl 4-[2-fluoro-4-(4-pentylcyclohexyl)phenyl]benzoate CAS Name: 4-[2-fluoro-4-(4-pentylcyclohexyl)phenyl]benzoic acid pentyl ester IUPAC Name: pentyl 4-[2-fluoro-4-(4-pentylcyclohexyl)phenyl]benzoate Traditional Name: 4-[4-(4-amylcyclohexyl)-2-fluoro-phenyl]benzoic acid amyl ester Formula: C29H39FO2 MolecularWeight: 438.617163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H39FO2/c1-3-5-7-9-22-10-12-23(13-11-22)26-18-19-27(28(30)21-26)24-14-16-25(17-15-24)29(31)32-20-8-6-4-2/h14-19,21-23H,3-13,20H2,1-2H3