5-[1-(6-oxidanyl-6-oxidanylidene-hexan-2-yl)oxypentadec-2-ynoxy]hexanoic acid

Systemtic Name: 5-[1-(6-oxidanyl-6-oxidanylidene-hexan-2-yl)oxypentadec-2-ynoxy]hexanoic acid Openeye Name: 5-[1-(5-hydroxy-1-methyl-5-oxo-pentoxy)pentadec-2-ynoxy]hexanoic acid CAS Name: 5-[1-(6-hydroxy-6-oxohexan-2-yl)oxypentadec-2-ynoxy]hexanoic acid IUPAC Name: 5-[1-(6-hydroxy-6-oxohexan-2-yl)oxypentadec-2-ynoxy]hexanoic acid Traditional Name: 5-[1-(5-hydroxy-5-keto-1-methyl-pentoxy)pentadec-2-ynoxy]hexanoic acid Formula: C27H48O6 MolecularWeight: 468.66642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC#CC(OC(C)CCCC(=O)O)OC(C)CCCC(=O)O

Isomeric SMILES

CCCCCCCCCCCCC#CC(OC(C)CCCC(=O)O)OC(C)CCCC(=O)O

InChI

InChI=1S/C27H48O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-22-27(32-23(2)18-16-20-25(28)29)33-24(3)19-17-21-26(30)31/h23-24,27H,4-14,16-21H2,1-3H3,(H,28,29)(H,30,31)