butyl 4-(4-butyl-2-fluoranyl-phenyl)benzoate

Systemtic Name: butyl 4-(4-butyl-2-fluoranyl-phenyl)benzoate Openeye Name: butyl 4-(4-butyl-2-fluoro-phenyl)benzoate CAS Name: 4-(4-butyl-2-fluorophenyl)benzoic acid butyl ester IUPAC Name: butyl 4-(4-butyl-2-fluorophenyl)benzoate Traditional Name: 4-(4-butyl-2-fluoro-phenyl)benzoic acid butyl ester Formula: C21H25FO2 MolecularWeight: 328.420403

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)C2=CC=C(C=C2)C(=O)OCCCC)F

Isomeric SMILES

CCCCC1=CC(=C(C=C1)C2=CC=C(C=C2)C(=O)OCCCC)F

InChI

InChI=1S/C21H25FO2/c1-3-5-7-16-8-13-19(20(22)15-16)17-9-11-18(12-10-17)21(23)24-14-6-4-2/h8-13,15H,3-7,14H2,1-2H3