AC1NRIJ0
(4E)-4-[(4-chlorophenyl)-hydroxymethylidene]-5-(4-nitrophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Also Known As: BAS 02378698|AB00116305-01|A2671/0113787|4-(4-chlorobenzoyl)-3-hydroxy-5-(4-nitrophenyl)-1-(pyridin-3-ylmethyl)-1H-pyrrol-2(5H)-one|(4E)-4-[(4-chlorophenyl)-hydroxymethylidene]-5-(4-nitrophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione|4-(4-CHLOROBENZOYL)-3-HYDROXY-5-(4-NITROPHENYL)-1-[(PYRIDIN-3-YL)METHYL]-2,5-DIHYDRO-1H-PYRROL-2-ONE|4-[(4-chlorophenyl)carbonyl]-3-hydroxy-5-(4-nitrophenyl)-1-(3-pyridylmethyl)-3 -pyrrolin-2-one
| Molecular Formula | C23H16ClN3O5 |
|---|---|
| Molecular Weight | 449.07785 g/mol |
| LogP | 4.2651 |
| Topological Polar Surface Area | 113.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 449.07785 |
| Monoisotopic Mass | 449.07785 |
| Heavy Atoms | 32 |
| Complexity | 1224.7513 |
Chemical Identifiers
| CAS Number | 335206-41-2 |
|---|---|
| SMILES | C1=CC(=CN=C1)CN2C(/C(=C(/C3=CC=C(C=C3)Cl)\O)/C(=O)C2=O)C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
AC1NRIJ0 (CAS 335206-41-2), with molecular formula C23H16ClN3O5 and molecular weight 449.07785 g/mol. IUPAC: (4E)-4-[(4-chlorophenyl)-hydroxymethylidene]-5-(4-nitrophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione.
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