2-(2,3,4,4,5,5-hexamethylhexan-2-ylsulfanyl)ethanoic acid

Systemtic Name: 2-(2,3,4,4,5,5-hexamethylhexan-2-ylsulfanyl)ethanoic acid Openeye Name: 2-(1,1,2,3,3,4,4-heptamethylpentylsulfanyl)acetic acid CAS Name: 2-(2,3,4,4,5,5-hexamethylhexan-2-ylthio)acetic acid IUPAC Name: 2-(2,3,4,4,5,5-hexamethylhexan-2-ylsulfanyl)acetic acid Traditional Name: 2-(1,1,2,3,3,4,4-heptamethylpentylthio)acetic acid Formula: C14H28O2S MolecularWeight: 260.43592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C)C(C)(C)C)C(C)(C)SCC(=O)O

Isomeric SMILES

CC(C(C)(C)C(C)(C)C)C(C)(C)SCC(=O)O

InChI

InChI=1S/C14H28O2S/c1-10(13(5,6)12(2,3)4)14(7,8)17-9-11(15)16/h10H,9H2,1-8H3,(H,15,16)