Chemical ID: 5689823

COc1ccc(c(c1)OC(=O)c2cccc(c2)N(=O)=O)C(=O)C=Cc3ccc(c(c3)OC)OC
Chemical ID:
5689823
Name [?]:
[2-[3-(3,4-dimethoxyphenyl)prop-2-enoyl]-5-methoxy-phenyl] 3-nitrobenzoate
SMILES [?]:
COc1ccc(c(c1)OC(=O)c2cccc(c2)N(=O)=O)C(=O)C=Cc3ccc(c(c3)OC)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H21NO8
All Atoms:34
Heavy Atoms:34
Chiral Atoms:0
ZAP Information [?]
Total:3.27193
Area:664.672
Solvation:-13.3449
Coulombic:-59.9352
Bond Count [?]
All:36
Single:22
Double:14
Rotors:10
Chiral:1
Rigid Segments:10
Chemical Properties
Molecular Weight:463.436
H-Bond Donors:0
H-Bond Acceptors:9
XLogP:4.72
LogP (Chemaxon):4.44

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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