3-ethynylhexanoyl 3-ethynylhexaneperoxoate

Systemtic Name: 3-ethynylhexanoyl 3-ethynylhexaneperoxoate Openeye Name: 3-ethynylhexanoyl 3-ethynylhexaneperoxoate CAS Name: 3-ethynylhexaneperoxoic acid (3-ethynyl-1-oxohexyl) ester IUPAC Name: 3-ethynylhexanoyl 3-ethynylhexaneperoxoate Traditional Name: 3-propylpent-4-yneperoxoic acid 3-propylpent-4-ynoyl ester Formula: C16H22O4 MolecularWeight: 278.34348

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC(=O)OOC(=O)CC(CCC)C#C)C#C

Isomeric SMILES

CCCC(CC(=O)OOC(=O)CC(CCC)C#C)C#C

InChI

InChI=1S/C16H22O4/c1-5-9-13(7-3)11-15(17)19-20-16(18)12-14(8-4)10-6-2/h3-4,13-14H,5-6,9-12H2,1-2H3