3-hexylsulfanyl-4-methyl-2-[(E)-3-oxidanyl-4-phenyl-but-1-enyl]cyclopent-3-en-1-ol

Systemtic Name: 3-hexylsulfanyl-4-methyl-2-[(E)-3-oxidanyl-4-phenyl-but-1-enyl]cyclopent-3-en-1-ol Openeye Name: 3-hexylsulfanyl-2-[(E)-3-hydroxy-4-phenyl-but-1-enyl]-4-methyl-cyclopent-3-en-1-ol CAS Name: 3-(hexylthio)-2-[(E)-3-hydroxy-4-phenylbut-1-enyl]-4-methyl-1-cyclopent-3-enol IUPAC Name: 3-hexylsulfanyl-2-[(E)-3-hydroxy-4-phenylbut-1-enyl]-4-methylcyclopent-3-en-1-ol Traditional Name: 3-(hexylthio)-2-[(E)-3-hydroxy-4-phenyl-but-1-enyl]-4-methyl-cyclopent-3-en-1-ol Formula: C22H32O2S MolecularWeight: 360.55328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=C(CC(C1C=CC(CC2=CC=CC=C2)O)O)C

Isomeric SMILES

CCCCCCSC1=C(CC(C1/C=C/C(CC2=CC=CC=C2)O)O)C

InChI

InChI=1S/C22H32O2S/c1-3-4-5-9-14-25-22-17(2)15-21(24)20(22)13-12-19(23)16-18-10-7-6-8-11-18/h6-8,10-13,19-21,23-24H,3-5,9,14-16H2,1-2H3/b13-12+