7-(3-pent-4-ynylsulfanyl-7-oxabicyclo[2.2.1]heptan-2-yl)heptanoic acid

Systemtic Name: 7-(3-pent-4-ynylsulfanyl-7-oxabicyclo[2.2.1]heptan-2-yl)heptanoic acid Openeye Name: 7-(3-pent-4-ynylsulfanyl-7-oxabicyclo[2.2.1]heptan-2-yl)heptanoic acid CAS Name: 7-[3-(pent-4-ynylthio)-7-oxabicyclo[2.2.1]heptan-2-yl]heptanoic acid IUPAC Name: 7-(3-pent-4-ynylsulfanyl-7-oxabicyclo[2.2.1]heptan-2-yl)heptanoic acid Traditional Name: 7-[3-(pent-4-ynylthio)-7-oxabicyclo[2.2.1]heptan-2-yl]enanthic acid Formula: C18H28O3S MolecularWeight: 324.47812

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCCSC1C2CCC(C1CCCCCCC(=O)O)O2

Isomeric SMILES

C#CCCCSC1C2CCC(C1CCCCCCC(=O)O)O2

InChI

InChI=1S/C18H28O3S/c1-2-3-8-13-22-18-14(15-11-12-16(18)21-15)9-6-4-5-7-10-17(19)20/h1,14-16,18H,3-13H2,(H,19,20)