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

Systemtic Name: 3-[6-(3-methylbutyl)-2-oxidanyl-3-propyl-phenyl]sulfanylpropane-1,2-diol Openeye Name: 3-(2-hydroxy-6-isopentyl-3-propyl-phenyl)sulfanylpropane-1,2-diol CAS Name: 3-[[2-hydroxy-6-(3-methylbutyl)-3-propylphenyl]thio]propane-1,2-diol IUPAC Name: 3-[2-hydroxy-6-(3-methylbutyl)-3-propylphenyl]sulfanylpropane-1,2-diol Traditional Name: 3-[(2-hydroxy-6-isoamyl-3-propyl-phenyl)thio]propane-1,2-diol Formula: C17H28O3S MolecularWeight: 312.46742

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(C=C1)CCC(C)C)SCC(CO)O)O

Isomeric SMILES

CCCC1=C(C(=C(C=C1)CCC(C)C)SCC(CO)O)O

InChI

InChI=1S/C17H28O3S/c1-4-5-13-8-9-14(7-6-12(2)3)17(16(13)20)21-11-15(19)10-18/h8-9,12,15,18-20H,4-7,10-11H2,1-3H3