Chemical ID: 5796494

Cc1cccc(c1OCC(=O)NN=Cc2ccccc2OC(=O)c3ccc(cc3)[N+](=O)[O-])C
Chemical ID:
5796494
Name [?]:
[2-[[2-(2,6-dimethylphenoxy)acetyl]aminoiminomethyl]phenyl] 4-nitrobenzoate
SMILES [?]:
Cc1cccc(c1OCC(=O)NN=Cc2ccccc2OC(=O)c3ccc(cc3)[N+](=O)[O-])C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H21N3O6
All Atoms:33
Heavy Atoms:33
Chiral Atoms:0
ZAP Information [?]
Total:6.30818
Area:704.1
Solvation:-11.2943
Coulombic:-58.2072
Bond Count [?]
All:35
Single:22
Double:13
Rotors:10
Chiral:1
Rigid Segments:8
Chemical Properties
Molecular Weight:447.44
H-Bond Donors:1
H-Bond Acceptors:9
XLogP:5.4
LogP (Chemaxon):5.13

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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