3-[3-ethyl-6-(3-methylbutyl)-2-oxidanyl-phenyl]sulfanylpropane-1,2-diol

Systemtic Name: 3-[3-ethyl-6-(3-methylbutyl)-2-oxidanyl-phenyl]sulfanylpropane-1,2-diol Openeye Name: 3-(3-ethyl-2-hydroxy-6-isopentyl-phenyl)sulfanylpropane-1,2-diol CAS Name: 3-[[3-ethyl-2-hydroxy-6-(3-methylbutyl)phenyl]thio]propane-1,2-diol IUPAC Name: 3-[3-ethyl-2-hydroxy-6-(3-methylbutyl)phenyl]sulfanylpropane-1,2-diol Traditional Name: 3-[(3-ethyl-2-hydroxy-6-isoamyl-phenyl)thio]propane-1,2-diol Formula: C16H26O3S MolecularWeight: 298.44084

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)CCC(C)C)SCC(CO)O)O

Isomeric SMILES

CCC1=C(C(=C(C=C1)CCC(C)C)SCC(CO)O)O

InChI

InChI=1S/C16H26O3S/c1-4-12-7-8-13(6-5-11(2)3)16(15(12)19)20-10-14(18)9-17/h7-8,11,14,17-19H,4-6,9-10H2,1-3H3