AC1MZKJK
1-[3-[(4-chlorophenyl)sulfonylmethyl]-4-nitrophenyl]-3-[4-(trifluoromethoxy)anilino]prop-2-en-1-one
Also Known As: KS-00003BEF|1-[3-[(4-chlorophenyl)sulfonylmethyl]-4-nitrophenyl]-3-[4-(trifluoromethoxy)anilino]prop-2-en-1-one|1-(3-{[(4-chlorophenyl)sulfonyl]methyl}-4-nitrophenyl)-3-[4-(trifluoromethoxy)anilino]-2-propen-1-one|1-[3-[[(4-Chlorophenyl)sulfonyl]methyl]-4-nitrophenyl]-3-[[4-(trifluoromethoxy)phenyl]amino]-2-propen-1-one
| Molecular Formula | C23H16ClF3N2O6S |
|---|---|
| Molecular Weight | 540.037 g/mol |
| LogP | 5.9292 |
| Topological Polar Surface Area | 115.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 540.037 |
| Monoisotopic Mass | 540.037 |
| Heavy Atoms | 36 |
| Complexity | 1407.2567 |
Chemical Identifiers
| CAS Number | 338968-29-9 |
|---|---|
| SMILES | C1=CC(=CC=C1NC=CC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])CS(=O)(=O)C3=CC=C(C=C3)Cl)OC(F)(F)F |
Product Overview
AC1MZKJK (CAS 338968-29-9), with molecular formula C23H16ClF3N2O6S and molecular weight 540.037 g/mol. IUPAC: 1-[3-[(4-chlorophenyl)sulfonylmethyl]-4-nitrophenyl]-3-[4-(trifluoromethoxy)anilino]prop-2-en-1-one.
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