AC1NWQCR
3-[(E)-4-(1,3-benzodioxol-5-yl)-2-oxobut-3-enyl]-1-[(4-chlorophenyl)methyl]-3-hydroxyindol-2-one
Also Known As: AB00119651-01|3-[(3E)-4-(1,3-benzodioxol-5-yl)-2-oxobut-3-en-1-yl]-1-(4-chlorobenzyl)-3-hydroxy-1,3-dihydro-2H-indol-2-one|3-[(E)-4-(1,3-benzodioxol-5-yl)-2-oxobut-3-enyl]-1-[(4-chlorophenyl)methyl]-3-hydroxyindol-2-one|(E)-3-(4-(benzo[d][1,3]dioxol-5-yl)-2-oxobut-3-en-1-yl)-1-(4-chlorobenzyl)-3-hydroxyindolin-2-one|3-((3E)-4-(2H-benzo[3,4-d]1,3-dioxolan-5-yl)-2-oxobut-3-enyl)-1-[(4-chlorophen yl)methyl]-3-hydroxyindolin-2-one|3-(4-benzo[1,3]dioxol-5-yl-2-oxo-but-3-enyl)-1-[(4-chlorophenyl)methyl]-3-hydroxy-indol-2-one
| Molecular Formula | C26H20ClNO5 |
|---|---|
| Molecular Weight | 461.103 g/mol |
| LogP | 4.4757 |
| Topological Polar Surface Area | 76.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 461.103 |
| Monoisotopic Mass | 461.103 |
| Heavy Atoms | 33 |
| Complexity | 1269.9288 |
Chemical Identifiers
| CAS Number | 355429-01-5 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)/C=C/C(=O)CC3(C4=CC=CC=C4N(C3=O)CC5=CC=C(C=C5)Cl)O |
Product Overview
AC1NWQCR (CAS 355429-01-5), with molecular formula C26H20ClNO5 and molecular weight 461.103 g/mol. IUPAC: 3-[(E)-4-(1,3-benzodioxol-5-yl)-2-oxobut-3-enyl]-1-[(4-chlorophenyl)methyl]-3-hydroxyindol-2-one.
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