4-methyl-6,6-bis(phenylsulfonyl)hexan-3-one

Systemtic Name: 4-methyl-6,6-bis(phenylsulfonyl)hexan-3-one Openeye Name: 6,6-bis(benzenesulfonyl)-4-methyl-hexan-3-one CAS Name: 6,6-bis(benzenesulfonyl)-4-methyl-3-hexanone IUPAC Name: 6,6-bis(benzenesulfonyl)-4-methylhexan-3-one Traditional Name: 6,6-dibesyl-4-methyl-hexan-3-one Formula: C19H22O5S2 MolecularWeight: 394.50498

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C)CC(S(=O)(=O)C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCC(=O)C(C)CC(S(=O)(=O)C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H22O5S2/c1-3-18(20)15(2)14-19(25(21,22)16-10-6-4-7-11-16)26(23,24)17-12-8-5-9-13-17/h4-13,15,19H,3,14H2,1-2H3