3-(4-methylsulfanylphenyl)-4-oxaspiro[4.5]dec-2-en-1-one

Systemtic Name: 3-(4-methylsulfanylphenyl)-4-oxaspiro[4.5]dec-2-en-1-one Openeye Name: 3-(4-methylsulfanylphenyl)-4-oxaspiro[4.5]dec-2-en-1-one CAS Name: 3-[4-(methylthio)phenyl]-4-oxaspiro[4.5]dec-2-en-1-one IUPAC Name: 3-(4-methylsulfanylphenyl)-4-oxaspiro[4.5]dec-2-en-1-one Traditional Name: 3-[4-(methylthio)phenyl]-4-oxaspiro[4.5]dec-2-en-1-one Formula: C16H18O2S MolecularWeight: 274.37792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=CC(=O)C3(O2)CCCCC3

Isomeric SMILES

CSC1=CC=C(C=C1)C2=CC(=O)C3(O2)CCCCC3

InChI

InChI=1S/C16H18O2S/c1-19-13-7-5-12(6-8-13)14-11-15(17)16(18-14)9-3-2-4-10-16/h5-8,11H,2-4,9-10H2,1H3