4-methyl-6-(oxiran-2-yl)-2-(phenylsulfonyl)heptan-3-one

Systemtic Name: 4-methyl-6-(oxiran-2-yl)-2-(phenylsulfonyl)heptan-3-one Openeye Name: 2-(benzenesulfonyl)-4-methyl-6-(oxiran-2-yl)heptan-3-one CAS Name: 2-(benzenesulfonyl)-4-methyl-6-(2-oxiranyl)-3-heptanone IUPAC Name: 2-(benzenesulfonyl)-4-methyl-6-(oxiran-2-yl)heptan-3-one Traditional Name: 2-besyl-4-methyl-6-(oxiran-2-yl)heptan-3-one Formula: C16H22O4S MolecularWeight: 310.40848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)C(=O)C(C)S(=O)(=O)C1=CC=CC=C1)C2CO2

Isomeric SMILES

CC(CC(C)C(=O)C(C)S(=O)(=O)C1=CC=CC=C1)C2CO2

InChI

InChI=1S/C16H22O4S/c1-11(15-10-20-15)9-12(2)16(17)13(3)21(18,19)14-7-5-4-6-8-14/h4-8,11-13,15H,9-10H2,1-3H3