2-[(2,2-dimethyl-1,3-dioxolan-4-yl)methylsulfanylmethyl]-4-(hydroxymethyl)cyclopentan-1-one

Systemtic Name: 2-[(2,2-dimethyl-1,3-dioxolan-4-yl)methylsulfanylmethyl]-4-(hydroxymethyl)cyclopentan-1-one Openeye Name: 2-[(2,2-dimethyl-1,3-dioxolan-4-yl)methylsulfanylmethyl]-4-(hydroxymethyl)cyclopentanone CAS Name: 2-[[(2,2-dimethyl-1,3-dioxolan-4-yl)methylthio]methyl]-4-(hydroxymethyl)-1-cyclopentanone IUPAC Name: 2-[(2,2-dimethyl-1,3-dioxolan-4-yl)methylsulfanylmethyl]-4-(hydroxymethyl)cyclopentan-1-one Traditional Name: 2-[[(2,2-dimethyl-1,3-dioxolan-4-yl)methylthio]methyl]-4-methylol-cyclopentanone Formula: C13H22O4S MolecularWeight: 274.37638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)CSCC2CC(CC2=O)CO)C

Isomeric SMILES

CC1(OCC(O1)CSCC2CC(CC2=O)CO)C

InChI

InChI=1S/C13H22O4S/c1-13(2)16-6-11(17-13)8-18-7-10-3-9(5-14)4-12(10)15/h9-11,14H,3-8H2,1-2H3