7-[5-(1-oxidanylhepta-2,4,6-triynyl)-2-oxidanylidene-1,3-dioxolan-4-yl]heptanoic acid carbonate

Systemtic Name: 7-[5-(1-oxidanylhepta-2,4,6-triynyl)-2-oxidanylidene-1,3-dioxolan-4-yl]heptanoic acid carbonate Openeye Name: 7-[5-(1-hydroxyhepta-2,4,6-triynyl)-2-oxo-1,3-dioxolan-4-yl]heptanoic acid carbonate CAS Name: 7-[5-(1-hydroxyhepta-2,4,6-triynyl)-2-oxo-1,3-dioxolan-4-yl]heptanoic acid carbonate IUPAC Name: 7-[5-(1-hydroxyhepta-2,4,6-triynyl)-2-oxo-1,3-dioxolan-4-yl]heptanoic acid carbonate Traditional Name: 7-[5-(1-hydroxyhepta-2,4,6-triynyl)-2-keto-1,3-dioxolan-4-yl]enanthic acid carbonate Formula: C18H18O9-2 MolecularWeight: 378.33012

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Descriptors Computed from Structure

Canonical SMILES:

C#CC#CC#CC(C1C(OC(=O)O1)CCCCCCC(=O)O)O.C(=O)([O-])[O-]

Isomeric SMILES

C#CC#CC#CC(C1C(OC(=O)O1)CCCCCCC(=O)O)O.C(=O)([O-])[O-]

InChI

InChI=1S/C17H18O6.CH2O3/c1-2-3-4-7-10-13(18)16-14(22-17(21)23-16)11-8-5-6-9-12-15(19)20;2-1(3)4/h1,13-14,16,18H,5-6,8-9,11-12H2,(H,19,20);(H2,2,3,4)/p-2