AC1LXNKE
methyl (4Z)-1-ethyl-2-methyl-4-[(4-methylphenyl)methylidene]-5-oxopyrrole-3-carboxylate
Also Known As: BIM-0038804.P001|SR-01000224195-1|methyl 1-ethyl-2-methyl-4-(4-methylbenzylidene)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate|methyl (4Z)-1-ethyl-2-methyl-4-[(4-methylphenyl)methylidene]-5-oxopyrrole-3-carboxylate|(Z)-methyl 1-ethyl-2-methyl-4-(4-methylbenzylidene)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate|methyl (4Z)-1-ethyl-2-methyl-4-(4-methylbenzylidene)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate|Methyl (4Z)-1-ethyl-2-methyl-4-[(4-methylphenyl)methylidene]-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
| Molecular Formula | C17H19NO3 |
|---|---|
| Molecular Weight | 285.1365 g/mol |
| LogP | 2.68752 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 285.1365 |
| Monoisotopic Mass | 285.1365 |
| Heavy Atoms | 21 |
| Complexity | 638.50397 |
Chemical Identifiers
| CAS Number | 5952-40-9 |
|---|---|
| SMILES | CCN1C(=C(/C(=C/C2=CC=C(C=C2)C)/C1=O)C(=O)OC)C |
Product Overview
AC1LXNKE (CAS 5952-40-9), with molecular formula C17H19NO3 and molecular weight 285.1365 g/mol. IUPAC: methyl (4Z)-1-ethyl-2-methyl-4-[(4-methylphenyl)methylidene]-5-oxopyrrole-3-carboxylate.
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