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4-octan-2-ylsulfanylbenzene-1,2-diol

4-octan-2-ylsulfanylbenzene-1,2-diol

Systemtic Name:4-octan-2-ylsulfanylbenzene-1,2-diol
Openeye Name:4-(1-methylheptylsulfanyl)benzene-1,2-diol
CAS Name:4-(octan-2-ylthio)benzene-1,2-diol
IUPAC Name:4-octan-2-ylsulfanylbenzene-1,2-diol
Traditional Name:4-(1-methylheptylthio)pyrocatechol
Formula: C14H22O2S
MolecularWeight: 254.38828
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)SC1=CC(=C(C=C1)O)O


Isomeric SMILES

CCCCCCC(C)SC1=CC(=C(C=C1)O)O


InChI

InChI=1S/C14H22O2S/c1-3-4-5-6-7-11(2)17-12-8-9-13(15)14(16)10-12/h8-11,15-16H,3-7H2,1-2H3


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