2-ethyl-4,4-dimethyl-3-(2-sulfanylethyl)pentanoic acid

Systemtic Name: 2-ethyl-4,4-dimethyl-3-(2-sulfanylethyl)pentanoic acid Openeye Name: 2-ethyl-4,4-dimethyl-3-(2-sulfanylethyl)pentanoic acid CAS Name: 2-ethyl-3-(2-mercaptoethyl)-4,4-dimethylpentanoic acid IUPAC Name: 2-ethyl-4,4-dimethyl-3-(2-sulfanylethyl)pentanoic acid Traditional Name: 2-ethyl-3-(2-mercaptoethyl)-4,4-dimethyl-valeric acid Formula: C11H22O2S MolecularWeight: 218.35618

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CCS)C(C)(C)C)C(=O)O

Isomeric SMILES

CCC(C(CCS)C(C)(C)C)C(=O)O

InChI

InChI=1S/C11H22O2S/c1-5-8(10(12)13)9(6-7-14)11(2,3)4/h8-9,14H,5-7H2,1-4H3,(H,12,13)