3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]sulfanylpropanoic acid

Systemtic Name: 3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]sulfanylpropanoic acid Openeye Name: 3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]sulfanylpropanoic acid CAS Name: 3-[[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]thio]propanoic acid IUPAC Name: 3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]sulfanylpropanoic acid Traditional Name: 3-[[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]thio]propionic acid Formula: C18H30O2S MolecularWeight: 310.4946

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCCC(=CCSCCC(=O)O)C)C)C

Isomeric SMILES

CC(=CCC/C(=C/CC/C(=C/CSCCC(=O)O)/C)/C)C

InChI

InChI=1S/C18H30O2S/c1-15(2)7-5-8-16(3)9-6-10-17(4)11-13-21-14-12-18(19)20/h7,9,11H,5-6,8,10,12-14H2,1-4H3,(H,19,20)/b16-9+,17-11+