AC1NWMII
(4E)-4-[(4-bromophenyl)-hydroxymethylidene]-1-[3-(dimethylamino)propyl]-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Also Known As: Oprea1_070762|UPCMLD0ENAT5960223:001|AB00113681-01|4-(4-bromobenzoyl)-1-(3-(dimethylamino)propyl)-3-hydroxy-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one|(4E)-4-[(4-bromophenyl)-hydroxymethylidene]-1-[3-(dimethylamino)propyl]-5-(3-nitrophenyl)pyrrolidine-2,3-dione|4-[(4-bromophenyl)carbonyl]-1-[3-(dimethylamino)propyl]-3-hydroxy-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C22H22BrN3O5 |
|---|---|
| Molecular Weight | 487.07428 g/mol |
| LogP | 3.7307 |
| Topological Polar Surface Area | 103.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 487.07428 |
| Monoisotopic Mass | 487.07428 |
| Heavy Atoms | 31 |
| Complexity | 1049.3668 |
Chemical Identifiers
| CAS Number | 381702-13-2 |
|---|---|
| SMILES | CN(C)CCCN1C(/C(=C(/C2=CC=C(C=C2)Br)\O)/C(=O)C1=O)C3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
AC1NWMII (CAS 381702-13-2), with molecular formula C22H22BrN3O5 and molecular weight 487.07428 g/mol. IUPAC: (4E)-4-[(4-bromophenyl)-hydroxymethylidene]-1-[3-(dimethylamino)propyl]-5-(3-nitrophenyl)pyrrolidine-2,3-dione.
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