3-methyl-1-(4-methylphenyl)sulfonyl-3-(phenylsulfinyl)piperidin-2-one

Systemtic Name: 3-methyl-1-(4-methylphenyl)sulfonyl-3-(phenylsulfinyl)piperidin-2-one Openeye Name: 3-(benzenesulfinyl)-3-methyl-1-(p-tolylsulfonyl)piperidin-2-one CAS Name: 3-(benzenesulfinyl)-3-methyl-1-(4-methylphenyl)sulfonyl-2-piperidinone IUPAC Name: 3-(benzenesulfinyl)-3-methyl-1-(4-methylphenyl)sulfonylpiperidin-2-one Traditional Name: 3-(benzenesulfinyl)-3-methyl-1-tosyl-2-piperidone Formula: C19H21NO4S2 MolecularWeight: 391.50434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2=O)(C)S(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2=O)(C)S(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H21NO4S2/c1-15-9-11-17(12-10-15)26(23,24)20-14-6-13-19(2,18(20)21)25(22)16-7-4-3-5-8-16/h3-5,7-12H,6,13-14H2,1-2H3