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

Systemtic Name: octyl 4-(5-butyl-1,3-dioxan-2-yl)-3-fluoranyl-benzoate Openeye Name: octyl 4-(5-butyl-1,3-dioxan-2-yl)-3-fluoro-benzoate CAS Name: 4-(5-butyl-1,3-dioxan-2-yl)-3-fluorobenzoic acid octyl ester IUPAC Name: octyl 4-(5-butyl-1,3-dioxan-2-yl)-3-fluorobenzoate Traditional Name: 4-(5-butyl-1,3-dioxan-2-yl)-3-fluoro-benzoic acid octyl ester Formula: C23H35FO4 MolecularWeight: 394.520003

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=CC(=C(C=C1)C2OCC(CO2)CCCC)F

Isomeric SMILES

CCCCCCCCOC(=O)C1=CC(=C(C=C1)C2OCC(CO2)CCCC)F

InChI

InChI=1S/C23H35FO4/c1-3-5-7-8-9-10-14-26-22(25)19-12-13-20(21(24)15-19)23-27-16-18(17-28-23)11-6-4-2/h12-13,15,18,23H,3-11,14,16-17H2,1-2H3