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

Systemtic Name: butyl 4-[2-fluoranyl-4-(4-propylcyclohexyl)phenyl]benzoate Openeye Name: butyl 4-[2-fluoro-4-(4-propylcyclohexyl)phenyl]benzoate CAS Name: 4-[2-fluoro-4-(4-propylcyclohexyl)phenyl]benzoic acid butyl ester IUPAC Name: butyl 4-[2-fluoro-4-(4-propylcyclohexyl)phenyl]benzoate Traditional Name: 4-[2-fluoro-4-(4-propylcyclohexyl)phenyl]benzoic acid butyl ester Formula: C26H33FO2 MolecularWeight: 396.537423

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)C3CCC(CC3)CCC)F

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)C3CCC(CC3)CCC)F

InChI

InChI=1S/C26H33FO2/c1-3-5-17-29-26(28)22-13-11-21(12-14-22)24-16-15-23(18-25(24)27)20-9-7-19(6-4-2)8-10-20/h11-16,18-20H,3-10,17H2,1-2H3