3-[2-[(4E)-4-nonylidene-2-oxidanyl-cyclohexyl]ethanoyloxysulfanyl]propanoic acid

Systemtic Name: 3-[2-[(4E)-4-nonylidene-2-oxidanyl-cyclohexyl]ethanoyloxysulfanyl]propanoic acid Openeye Name: 3-[2-[(4E)-2-hydroxy-4-nonylidene-cyclohexyl]acetyl]oxysulfanylpropanoic acid CAS Name: 3-[[2-[(4E)-2-hydroxy-4-nonylidenecyclohexyl]-1-oxoethoxy]thio]propanoic acid IUPAC Name: 3-[2-[(4E)-2-hydroxy-4-nonylidenecyclohexyl]acetyl]oxysulfanylpropanoic acid Traditional Name: 3-[[2-[(4E)-2-hydroxy-4-nonylidene-cyclohexyl]acetyl]oxythio]propionic acid Formula: C20H34O5S MolecularWeight: 386.54596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=C1CCC(C(C1)O)CC(=O)OSCCC(=O)O

Isomeric SMILES

CCCCCCCC/C=C/1\CCC(C(C1)O)CC(=O)OSCCC(=O)O

InChI

InChI=1S/C20H34O5S/c1-2-3-4-5-6-7-8-9-16-10-11-17(18(21)14-16)15-20(24)25-26-13-12-19(22)23/h9,17-18,21H,2-8,10-15H2,1H3,(H,22,23)/b16-9+