[Synonyms]
[Structure]
![2-ethoxy-6-[(4-morpholin-4-ylphenyl)iminomethyl]-4-nitrophenol,Canoni](/file/upload/dataimg/114/1138235.png)
[ Properties Computed from Structure]
[ Descriptors Computed from Structure]
IUPAC Name: 2-ethoxy-6-[(4-morpholin-4-ylphenyl)iminomethyl]-4-nitrophenol
Canonical SMILES: CCOC1=C(C(=CC(=C1)[N+](=O)[O-])C=NC2=CC=C(C=C2)N3CCOCC3)O
InChI: InChI=1/C19H21N3O5/c1-2-27-18-12-17(22(24)25)11-14(19(18)23)13-20-15-3-
5-16(6-4-15)21-7-9-26-10-8-21/h3-6,11-13,23H,2,7-10H2,1H3/b20-13+
[Structure]
[ Properties Computed from Structure]
| Molecular Weight | 371.38714 [g/mol] |
| Molecular Formula | C19H21N3O5 |
| XLogP | 3 |
| H-Bond Donor | 1 |
| H-Bond Acceptor | 7 |
| Rotatable Bond Count | 5 |
| Tautomer Count | 6 |
| Exact Mass | 371.148121 |
| MonoIsotopic Mass | 371.148121 |
| Topological Polar Surface Area | 97.4 |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 498 |
| Isotope Atom Count | 0 |
| Defined Atom StereoCenter Count | 0 |
| Undefined Atom StereoCenter Count | 0 |
| Defined Bond StereoCenter Count | 0 |
| Undefined Bond StereoCenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
[ Descriptors Computed from Structure]
IUPAC Name: 2-ethoxy-6-[(4-morpholin-4-ylphenyl)iminomethyl]-4-nitrophenol
Canonical SMILES: CCOC1=C(C(=CC(=C1)[N+](=O)[O-])C=NC2=CC=C(C=C2)N3CCOCC3)O
InChI: InChI=1/C19H21N3O5/c1-2-27-18-12-17(22(24)25)11-14(19(18)23)13-20-15-3-
5-16(6-4-15)21-7-9-26-10-8-21/h3-6,11-13,23H,2,7-10H2,1H3/b20-13+
