5-methylhexan-2-yl 4-acetyloxy-2-fluoranyl-benzoate

Systemtic Name: 5-methylhexan-2-yl 4-acetyloxy-2-fluoranyl-benzoate Openeye Name: 1,4-dimethylpentyl 4-acetoxy-2-fluoro-benzoate CAS Name: 4-acetyloxy-2-fluorobenzoic acid 5-methylhexan-2-yl ester IUPAC Name: 5-methylhexan-2-yl 4-acetyloxy-2-fluorobenzoate Traditional Name: 4-acetoxy-2-fluoro-benzoic acid 1,4-dimethylpentyl ester Formula: C16H21FO4 MolecularWeight: 296.333943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)OC(=O)C1=C(C=C(C=C1)OC(=O)C)F

Isomeric SMILES

CC(C)CCC(C)OC(=O)C1=C(C=C(C=C1)OC(=O)C)F

InChI

InChI=1S/C16H21FO4/c1-10(2)5-6-11(3)20-16(19)14-8-7-13(9-15(14)17)21-12(4)18/h7-11H,5-6H2,1-4H3