2-[(2E)-3,7-dimethylocta-2,6-dienyl]benzenesulfinic acid

Systemtic Name: 2-[(2E)-3,7-dimethylocta-2,6-dienyl]benzenesulfinic acid Openeye Name: 2-[(2E)-3,7-dimethylocta-2,6-dienyl]benzenesulfinic acid CAS Name: 2-[(2E)-3,7-dimethylocta-2,6-dienyl]benzenesulfinic acid IUPAC Name: 2-[(2E)-3,7-dimethylocta-2,6-dienyl]benzenesulfinic acid Traditional Name: 2-[(2E)-3,7-dimethylocta-2,6-dienyl]benzenesulfinic acid Formula: C16H22O2S MolecularWeight: 278.40968

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCC1=CC=CC=C1S(=O)O)C)C

Isomeric SMILES

CC(=CCC/C(=C/CC1=CC=CC=C1S(=O)O)/C)C

InChI

InChI=1S/C16H22O2S/c1-13(2)7-6-8-14(3)11-12-15-9-4-5-10-16(15)19(17)18/h4-5,7,9-11H,6,8,12H2,1-3H3,(H,17,18)/b14-11+