1-[2-ethyl-5-[(5-fluoranyl-2-methyl-phenyl)methoxy]-1,3-dioxan-4-yl]ethyl benzoate

Systemtic Name: 1-[2-ethyl-5-[(5-fluoranyl-2-methyl-phenyl)methoxy]-1,3-dioxan-4-yl]ethyl benzoate Openeye Name: 1-[2-ethyl-5-[(5-fluoro-2-methyl-phenyl)methoxy]-1,3-dioxan-4-yl]ethyl benzoate CAS Name: benzoic acid 1-[2-ethyl-5-[(5-fluoro-2-methylphenyl)methoxy]-1,3-dioxan-4-yl]ethyl ester IUPAC Name: 1-[2-ethyl-5-[(5-fluoro-2-methylphenyl)methoxy]-1,3-dioxan-4-yl]ethyl benzoate Traditional Name: benzoic acid 1-[2-ethyl-5-(5-fluoro-2-methyl-benzyl)oxy-1,3-dioxan-4-yl]ethyl ester Formula: C23H27FO5 MolecularWeight: 402.455883

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Descriptors Computed from Structure

Canonical SMILES:

CCC1OCC(C(O1)C(C)OC(=O)C2=CC=CC=C2)OCC3=C(C=CC(=C3)F)C

Isomeric SMILES

CCC1OCC(C(O1)C(C)OC(=O)C2=CC=CC=C2)OCC3=C(C=CC(=C3)F)C

InChI

InChI=1S/C23H27FO5/c1-4-21-27-14-20(26-13-18-12-19(24)11-10-15(18)2)22(29-21)16(3)28-23(25)17-8-6-5-7-9-17/h5-12,16,20-22H,4,13-14H2,1-3H3