2-dodecylsulfanyl-1-methyl-2-oxidanyl-cyclopropane-1-carboxylic acid

Systemtic Name: 2-dodecylsulfanyl-1-methyl-2-oxidanyl-cyclopropane-1-carboxylic acid Openeye Name: 2-dodecylsulfanyl-2-hydroxy-1-methyl-cyclopropanecarboxylic acid CAS Name: 2-(dodecylthio)-2-hydroxy-1-methyl-1-cyclopropanecarboxylic acid IUPAC Name: 2-dodecylsulfanyl-2-hydroxy-1-methylcyclopropane-1-carboxylic acid Traditional Name: 2-hydroxy-2-(laurylthio)-1-methyl-cyclopropanecarboxylic acid Formula: C17H32O3S MolecularWeight: 316.49918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC1(CC1(C)C(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCSC1(CC1(C)C(=O)O)O

InChI

InChI=1S/C17H32O3S/c1-3-4-5-6-7-8-9-10-11-12-13-21-17(20)14-16(17,2)15(18)19/h20H,3-14H2,1-2H3,(H,18,19)