[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]
![2-ethoxy-6-[(4-morpholin-4-ylphenyl)iminomethyl]-4-nitrophenol,Canoni](/file/upload/dataimg/114/1138235.png)
[ 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+