6-(1-iodanyl-3,5,5-trimethyl-hexoxy)-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-(1-iodanyl-3,5,5-trimethyl-hexoxy)-6-oxidanylidene-hexanoic acid Openeye Name: 6-(1-iodo-3,5,5-trimethyl-hexoxy)-6-oxo-hexanoic acid CAS Name: 6-(1-iodo-3,5,5-trimethylhexoxy)-6-oxohexanoic acid IUPAC Name: 6-(1-iodo-3,5,5-trimethylhexoxy)-6-oxohexanoic acid Traditional Name: 6-(1-iodo-3,5,5-trimethyl-hexoxy)-6-keto-hexanoic acid Formula: C15H27IO4 MolecularWeight: 398.27695

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(OC(=O)CCCCC(=O)O)I)CC(C)(C)C

Isomeric SMILES

CC(CC(OC(=O)CCCCC(=O)O)I)CC(C)(C)C

InChI

InChI=1S/C15H27IO4/c1-11(10-15(2,3)4)9-12(16)20-14(19)8-6-5-7-13(17)18/h11-12H,5-10H2,1-4H3,(H,17,18)