3-methyl-5-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonyl-1,3-benzoxazol-2-one

Systemtic Name: 3-methyl-5-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonyl-1,3-benzoxazol-2-one Openeye Name: 3-methyl-5-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonyl-1,3-benzoxazol-2-one CAS Name: 3-methyl-5-[[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]sulfonyl]-1,3-benzoxazol-2-one IUPAC Name: 3-methyl-5-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonyl-1,3-benzoxazol-2-one Traditional Name: 3-methyl-5-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]sulfonyl-1,3-benzoxazol-2-one Formula: C19H17F3N4O6S MolecularWeight: 486.42169

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-])OC1=O

Isomeric SMILES

CN1C2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-])OC1=O

InChI

InChI=1S/C19H17F3N4O6S/c1-23-16-11-13(3-5-17(16)32-18(23)27)33(30,31)25-8-6-24(7-9-25)14-4-2-12(19(20,21)22)10-15(14)26(28)29/h2-5,10-11H,6-9H2,1H3