2-methyl-5-oxidanyl-2-(phenylmethyl)thiophen-3-one

Systemtic Name: 2-methyl-5-oxidanyl-2-(phenylmethyl)thiophen-3-one Openeye Name: 2-benzyl-5-hydroxy-2-methyl-thiophen-3-one CAS Name: 5-hydroxy-2-methyl-2-(phenylmethyl)-3-thiophenone IUPAC Name: 2-benzyl-5-hydroxy-2-methylthiophen-3-one Traditional Name: 2-benzyl-5-hydroxy-2-methyl-thiophen-3-one Formula: C12H12O2S MolecularWeight: 220.28748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C=C(S1)O)CC2=CC=CC=C2

Isomeric SMILES

CC1(C(=O)C=C(S1)O)CC2=CC=CC=C2

InChI

InChI=1S/C12H12O2S/c1-12(10(13)7-11(14)15-12)8-9-5-3-2-4-6-9/h2-7,14H,8H2,1H3