1-methyl-4-(1-methylsulfanyloctan-4-ylsulfonyl)benzene

Systemtic Name: 1-methyl-4-(1-methylsulfanyloctan-4-ylsulfonyl)benzene Openeye Name: 1-methyl-4-[1-(3-methylsulfanylpropyl)pentylsulfonyl]benzene CAS Name: 1-methyl-4-[1-(methylthio)octan-4-ylsulfonyl]benzene IUPAC Name: 1-methyl-4-(1-methylsulfanyloctan-4-ylsulfonyl)benzene Traditional Name: 1-methyl-4-[1-[3-(methylthio)propyl]pentylsulfonyl]benzene Formula: C16H26O2S2 MolecularWeight: 314.50644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCSC)S(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCC(CCCSC)S(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C16H26O2S2/c1-4-5-7-15(8-6-13-19-3)20(17,18)16-11-9-14(2)10-12-16/h9-12,15H,4-8,13H2,1-3H3