butyl 3-fluoranyl-4-(5-hexyl-1,3-dioxan-2-yl)benzoate

Systemtic Name: butyl 3-fluoranyl-4-(5-hexyl-1,3-dioxan-2-yl)benzoate Openeye Name: butyl 3-fluoro-4-(5-hexyl-1,3-dioxan-2-yl)benzoate CAS Name: 3-fluoro-4-(5-hexyl-1,3-dioxan-2-yl)benzoic acid butyl ester IUPAC Name: butyl 3-fluoro-4-(5-hexyl-1,3-dioxan-2-yl)benzoate Traditional Name: 3-fluoro-4-(5-hexyl-1,3-dioxan-2-yl)benzoic acid butyl ester Formula: C21H31FO4 MolecularWeight: 366.466843

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1COC(OC1)C2=C(C=C(C=C2)C(=O)OCCCC)F

Isomeric SMILES

CCCCCCC1COC(OC1)C2=C(C=C(C=C2)C(=O)OCCCC)F

InChI

InChI=1S/C21H31FO4/c1-3-5-7-8-9-16-14-25-21(26-15-16)18-11-10-17(13-19(18)22)20(23)24-12-6-4-2/h10-11,13,16,21H,3-9,12,14-15H2,1-2H3