Chemical ID: 4402590

COc1ccc(c(c1)OC(=O)c2ccc(cc2)[N+](=O)[O-])C(=O)C=Cc3ccccc3OC
Chemical ID:
4402590
Name [?]:
[5-methoxy-2-[3-(2-methoxyphenyl)prop-2-enoyl]phenyl] 4-nitrobenzoate
SMILES [?]:
COc1ccc(c(c1)OC(=O)c2ccc(cc2)[N+](=O)[O-])C(=O)C=Cc3ccccc3OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H19NO7
All Atoms:32
Heavy Atoms:32
Chiral Atoms:0
ZAP Information [?]
Total:4.84547
Area:636.355
Solvation:-11.0634
Coulombic:-54.5192
Bond Count [?]
All:34
Single:21
Double:13
Rotors:9
Chiral:1
Rigid Segments:9
Chemical Properties
Molecular Weight:433.41
H-Bond Donors:0
H-Bond Acceptors:8
XLogP:4.95
LogP (Chemaxon):4.69

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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