2-[3-[2-methyl-5-[(E)-5-methyl-3-oxidanyl-non-1-enyl]cyclopenten-1-yl]sulfanylpropoxy]ethanoic acid

Systemtic Name: 2-[3-[2-methyl-5-[(E)-5-methyl-3-oxidanyl-non-1-enyl]cyclopenten-1-yl]sulfanylpropoxy]ethanoic acid Openeye Name: 2-[3-[5-[(E)-3-hydroxy-5-methyl-non-1-enyl]-2-methyl-cyclopenten-1-yl]sulfanylpropoxy]acetic acid CAS Name: 2-[3-[[5-[(E)-3-hydroxy-5-methylnon-1-enyl]-2-methyl-1-cyclopentenyl]thio]propoxy]acetic acid IUPAC Name: 2-[3-[5-[(E)-3-hydroxy-5-methylnon-1-enyl]-2-methylcyclopenten-1-yl]sulfanylpropoxy]acetic acid Traditional Name: 2-[3-[[5-[(E)-3-hydroxy-5-methyl-non-1-enyl]-2-methyl-cyclopenten-1-yl]thio]propoxy]acetic acid Formula: C21H36O4S MolecularWeight: 384.57314

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)CC(C=CC1CCC(=C1SCCCOCC(=O)O)C)O

Isomeric SMILES

CCCCC(C)CC(/C=C/C1CCC(=C1SCCCOCC(=O)O)C)O

InChI

InChI=1S/C21H36O4S/c1-4-5-7-16(2)14-19(22)11-10-18-9-8-17(3)21(18)26-13-6-12-25-15-20(23)24/h10-11,16,18-19,22H,4-9,12-15H2,1-3H3,(H,23,24)/b11-10+