7-[3-(cyclohexylsulfanylmethyl)-7-oxabicyclo[2.2.1]heptan-2-yl]heptanoic acid

Systemtic Name: 7-[3-(cyclohexylsulfanylmethyl)-7-oxabicyclo[2.2.1]heptan-2-yl]heptanoic acid Openeye Name: 7-[3-(cyclohexylsulfanylmethyl)-7-oxabicyclo[2.2.1]heptan-2-yl]heptanoic acid CAS Name: 7-[3-[(cyclohexylthio)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]heptanoic acid IUPAC Name: 7-[3-(cyclohexylsulfanylmethyl)-7-oxabicyclo[2.2.1]heptan-2-yl]heptanoic acid Traditional Name: 7-[3-[(cyclohexylthio)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]enanthic acid Formula: C20H34O3S MolecularWeight: 354.54716

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SCC2C3CCC(C2CCCCCCC(=O)O)O3

Isomeric SMILES

C1CCC(CC1)SCC2C3CCC(C2CCCCCCC(=O)O)O3

InChI

InChI=1S/C20H34O3S/c21-20(22)11-7-2-1-6-10-16-17(19-13-12-18(16)23-19)14-24-15-8-4-3-5-9-15/h15-19H,1-14H2,(H,21,22)