AC1LPKSE
3-[[2-chloro-4-[(E)-(2,5-dioxoimidazolidin-4-ylidene)methyl]-6-ethoxyphenoxy]methyl]benzoic acid
Also Known As: NCGC00341368-01|AB00116725-01|AB00116725-04|SR-01000488716-1|(E)-3-((2-chloro-4-((2,5-dioxoimidazolidin-4-ylidene)methyl)-6-ethoxyphenoxy)methyl)benzoic acid|3-({2-chloro-4-[(E)-(2,5-dioxoimidazolidin-4-ylidene)methyl]-6-ethoxyphenoxy}methyl)benzoic acid|3-[(2-CHLORO-4-{[(4E)-2,5-DIOXOIMIDAZOLIDIN-4-YLIDENE]METHYL}-6-ETHOXYPHENOXY)METHYL]BENZOIC ACID|3-[[2-chloro-4-[(2,5-dioxoimidazolidin-4-ylidene)methyl]-6-ethoxy-phenoxy]methyl]benzoic Acid|3-[[2-chloro-4-[(E)-(2,5-dioxoimidazolidin-4-ylidene)methyl]-6-ethoxyphenoxy]methyl]benzoic acid
| Molecular Formula | C20H17ClN2O6 |
|---|---|
| Molecular Weight | 416.0775 g/mol |
| LogP | 3.1962 |
| Topological Polar Surface Area | 113.96 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 416.0775 |
| Monoisotopic Mass | 416.0775 |
| Heavy Atoms | 29 |
| Complexity | 1018.0262 |
Chemical Identifiers
| CAS Number | 431925-85-8 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)/C=C/2\C(=O)NC(=O)N2)Cl)OCC3=CC(=CC=C3)C(=O)O |
Product Overview
AC1LPKSE (CAS 431925-85-8), with molecular formula C20H17ClN2O6 and molecular weight 416.0775 g/mol. IUPAC: 3-[[2-chloro-4-[(E)-(2,5-dioxoimidazolidin-4-ylidene)methyl]-6-ethoxyphenoxy]methyl]benzoic acid.
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