Chemical ID: 5789309

COc1cc(c(c(c1)OC)C(=O)C=Cc2cccc(c2)[N+](=O)[O-])OC
Chemical ID:
5789309
Name [?]:
3-(3-nitrophenyl)-1-(2,4,6-trimethoxyphenyl)-prop-2-en-1-one
SMILES [?]:
COc1cc(c(c(c1)OC)C(=O)C=Cc2cccc(c2)[N+](=O)[O-])OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H17NO6
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:2.97354
Area:532.43
Solvation:-10.3372
Coulombic:-42.2111
Bond Count [?]
All:26
Single:17
Double:9
Rotors:7
Chiral:1
Rigid Segments:8
Chemical Properties
Molecular Weight:343.331
H-Bond Donors:0
H-Bond Acceptors:7
XLogP:3.36
LogP (Chemaxon):3.21

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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