7-(4,4-dimethyl-7-oxidanyl-heptyl)sulfanyl-4,4-dimethyl-heptanoic acid

Systemtic Name: 7-(4,4-dimethyl-7-oxidanyl-heptyl)sulfanyl-4,4-dimethyl-heptanoic acid Openeye Name: 7-(7-hydroxy-4,4-dimethyl-heptyl)sulfanyl-4,4-dimethyl-heptanoic acid CAS Name: 7-[(7-hydroxy-4,4-dimethylheptyl)thio]-4,4-dimethylheptanoic acid IUPAC Name: 7-(7-hydroxy-4,4-dimethylheptyl)sulfanyl-4,4-dimethylheptanoic acid Traditional Name: 7-[(7-hydroxy-4,4-dimethyl-heptyl)thio]-4,4-dimethyl-enanthic acid Formula: C18H36O3S MolecularWeight: 332.54164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCO)CCCSCCCC(C)(C)CCC(=O)O

Isomeric SMILES

CC(C)(CCCO)CCCSCCCC(C)(C)CCC(=O)O

InChI

InChI=1S/C18H36O3S/c1-17(2,9-5-13-19)10-6-14-22-15-7-11-18(3,4)12-8-16(20)21/h19H,5-15H2,1-4H3,(H,20,21)