4-methoxy-6-(2-oxidanylidenepropylsulfanylmethyl)pyran-2-one

Systemtic Name: 4-methoxy-6-(2-oxidanylidenepropylsulfanylmethyl)pyran-2-one Openeye Name: 6-(acetonylsulfanylmethyl)-4-methoxy-pyran-2-one CAS Name: 4-methoxy-6-[(2-oxopropylthio)methyl]-2-pyranone IUPAC Name: 4-methoxy-6-(2-oxopropylsulfanylmethyl)pyran-2-one Traditional Name: 6-[(acetonylthio)methyl]-4-methoxy-pyran-2-one Formula: C10H12O4S MolecularWeight: 228.26488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSCC1=CC(=CC(=O)O1)OC

Isomeric SMILES

CC(=O)CSCC1=CC(=CC(=O)O1)OC

InChI

InChI=1S/C10H12O4S/c1-7(11)5-15-6-9-3-8(13-2)4-10(12)14-9/h3-4H,5-6H2,1-2H3