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

Systemtic Name: propyl 4-(4-butyl-2-fluoranyl-phenyl)benzoate Openeye Name: propyl 4-(4-butyl-2-fluoro-phenyl)benzoate CAS Name: 4-(4-butyl-2-fluorophenyl)benzoic acid propyl ester IUPAC Name: propyl 4-(4-butyl-2-fluorophenyl)benzoate Traditional Name: 4-(4-butyl-2-fluoro-phenyl)benzoic acid propyl ester Formula: C20H23FO2 MolecularWeight: 314.393823

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23FO2/c1-3-5-6-15-7-12-18(19(21)14-15)16-8-10-17(11-9-16)20(22)23-13-4-2/h7-12,14H,3-6,13H2,1-2H3