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2-methyloct-5-yn-4-yl 2,3,4-tris(fluoranyl)benzoate

2-methyloct-5-yn-4-yl 2,3,4-tris(fluoranyl)benzoate

Systemtic Name:2-methyloct-5-yn-4-yl 2,3,4-tris(fluoranyl)benzoate
Openeye Name:1-isobutylpent-2-ynyl 2,3,4-trifluorobenzoate
CAS Name:2,3,4-trifluorobenzoic acid 2-methyloct-5-yn-4-yl ester
IUPAC Name:2-methyloct-5-yn-4-yl 2,3,4-trifluorobenzoate
Traditional Name:2,3,4-trifluorobenzoic acid 1-isobutylpent-2-ynyl ester
Formula: C16H17F3O2
MolecularWeight: 298.30019
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C16H17F3O2/c1-4-5-6-11(9-10(2)3)21-16(20)12-7-8-13(17)15(19)14(12)18/h7-8,10-11H,4,9H2,1-3H3


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