AC1O5MQZ
2-[N-(2-benzoyloxyethyl)-4-[(E)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]anilino]ethyl benzoate
Also Known As: 2-Propenoic acid, 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyano-, ethyl ester|Cinnamic acid, p-(bis(2-hydroxyethyl)amino)-alpha-cyano-, ethyl ester, dibenzoate (ester)|Ethyl 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyanoacrylate|Ethyl 3-[4-[bis[2-(benzoyloxy)ethyl]amino]phenyl]-2-cyanoacrylate|2-Propenoic acid, 3-[4-[bis[2-(benzoyloxy)ethyl]amino]phenyl]-2-cyano-, ethyl ester|{[4-(2-Cyano-3-ethoxy-3-oxoprop-1-en-1-yl)phenyl]azanediyl}di(ethane-2,1-diyl) dibenzoate|2-[N-(2-benzoyloxyethyl)-4-[(E)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]anilino]ethyl benzoate
| Molecular Formula | C30H28N2O6 |
|---|---|
| Molecular Weight | 512.19476 g/mol |
| LogP | 4.67708 |
| Topological Polar Surface Area | 105.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 12 |
| Exact Mass | 512.19476 |
| Monoisotopic Mass | 512.19476 |
| Heavy Atoms | 38 |
| Complexity | 1224.3281 |
Chemical Identifiers
| CAS Number | 65086-95-5 |
|---|---|
| SMILES | CCOC(=O)/C(=C/C1=CC=C(C=C1)N(CCOC(=O)C2=CC=CC=C2)CCOC(=O)C3=CC=CC=C3)/C#N |
Product Overview
AC1O5MQZ (CAS 65086-95-5), with molecular formula C30H28N2O6 and molecular weight 512.19476 g/mol. IUPAC: 2-[N-(2-benzoyloxyethyl)-4-[(E)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]anilino]ethyl benzoate.
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