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2-(1-sulfanylhexan-2-yl)pentanedioic acid

2-(1-sulfanylhexan-2-yl)pentanedioic acid

Systemtic Name:2-(1-sulfanylhexan-2-yl)pentanedioic acid
Openeye Name:2-[1-(sulfanylmethyl)pentyl]pentanedioic acid
CAS Name:2-(1-mercaptohexan-2-yl)pentanedioic acid
IUPAC Name:2-(1-sulfanylhexan-2-yl)pentanedioic acid
Traditional Name:2-[1-(mercaptomethyl)pentyl]glutaric acid
Formula: C11H20O4S
MolecularWeight: 248.3391
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CS)C(CCC(=O)O)C(=O)O


Isomeric SMILES

CCCCC(CS)C(CCC(=O)O)C(=O)O


InChI

InChI=1S/C11H20O4S/c1-2-3-4-8(7-16)9(11(14)15)5-6-10(12)13/h8-9,16H,2-7H2,1H3,(H,12,13)(H,14,15)


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