1-[5-(hydroxymethyl)-4-methyl-2,5-dihydrothiophen-2-yl]propan-2-one

Systemtic Name: 1-[5-(hydroxymethyl)-4-methyl-2,5-dihydrothiophen-2-yl]propan-2-one Openeye Name: 1-[5-(hydroxymethyl)-4-methyl-2,5-dihydrothiophen-2-yl]propan-2-one CAS Name: 1-[5-(hydroxymethyl)-4-methyl-2,5-dihydrothiophen-2-yl]-2-propanone IUPAC Name: 1-[5-(hydroxymethyl)-4-methyl-2,5-dihydrothiophen-2-yl]propan-2-one Traditional Name: 1-(4-methyl-5-methylol-2,5-dihydrothiophen-2-yl)acetone Formula: C9H14O2S MolecularWeight: 186.27126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(SC1CO)CC(=O)C

Isomeric SMILES

CC1=CC(SC1CO)CC(=O)C

InChI

InChI=1S/C9H14O2S/c1-6-3-8(4-7(2)11)12-9(6)5-10/h3,8-10H,4-5H2,1-2H3