2-[(2Z)-3,7-dimethylocta-2,6-dienyl]sulfanylbenzoic acid

Systemtic Name: 2-[(2Z)-3,7-dimethylocta-2,6-dienyl]sulfanylbenzoic acid Openeye Name: 2-[(2Z)-3,7-dimethylocta-2,6-dienyl]sulfanylbenzoic acid CAS Name: 2-[[(2Z)-3,7-dimethylocta-2,6-dienyl]thio]benzoic acid IUPAC Name: 2-[(2Z)-3,7-dimethylocta-2,6-dienyl]sulfanylbenzoic acid Traditional Name: 2-[[(2Z)-3,7-dimethylocta-2,6-dienyl]thio]benzoic acid Formula: C17H22O2S MolecularWeight: 290.42038

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCSC1=CC=CC=C1C(=O)O)C)C

Isomeric SMILES

CC(=CCC/C(=C\CSC1=CC=CC=C1C(=O)O)/C)C

InChI

InChI=1S/C17H22O2S/c1-13(2)7-6-8-14(3)11-12-20-16-10-5-4-9-15(16)17(18)19/h4-5,7,9-11H,6,8,12H2,1-3H3,(H,18,19)/b14-11-