5-tert-butyl-2-[2-decylsulfonyl-5-(trifluoromethyl)phenyl]-1,2-oxazol-3-one

Systemtic Name: 5-tert-butyl-2-[2-decylsulfonyl-5-(trifluoromethyl)phenyl]-1,2-oxazol-3-one Openeye Name: 5-tert-butyl-2-[2-decylsulfonyl-5-(trifluoromethyl)phenyl]isoxazol-3-one CAS Name: 5-tert-butyl-2-[2-decylsulfonyl-5-(trifluoromethyl)phenyl]-3-isoxazolone IUPAC Name: 5-tert-butyl-2-[2-decylsulfonyl-5-(trifluoromethyl)phenyl]-1,2-oxazol-3-one Traditional Name: 5-tert-butyl-2-[2-decylsulfonyl-5-(trifluoromethyl)phenyl]-4-isoxazolin-3-one Formula: C24H34F3NO4S MolecularWeight: 489.59127

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCS(=O)(=O)C1=C(C=C(C=C1)C(F)(F)F)N2C(=O)C=C(O2)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCS(=O)(=O)C1=C(C=C(C=C1)C(F)(F)F)N2C(=O)C=C(O2)C(C)(C)C

InChI

InChI=1S/C24H34F3NO4S/c1-5-6-7-8-9-10-11-12-15-33(30,31)20-14-13-18(24(25,26)27)16-19(20)28-22(29)17-21(32-28)23(2,3)4/h13-14,16-17H,5-12,15H2,1-4H3