Chemical ID: 5287222

CCOC(=O)c1ccc(cc1)NC=C(C(=O)OCC)C(=O)OCC
Chemical ID:
5287222
Name [?]:
diethyl 2-[(4-ethoxycarbonylphenyl)aminomethylene]propanedioate
SMILES [?]:
CCOC(=O)c1ccc(cc1)NC=C(C(=O)OCC)C(=O)OCC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H21NO6
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:11.0045
Area:581.391
Solvation:-3.53028
Coulombic:-69.6232
Bond Count [?]
All:24
Single:17
Double:7
Rotors:11
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:335.352
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:4.1
LogP (Chemaxon):1.82

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue