Chemical ID: 5794854

Cc1cccc(c1)OCC(=O)NN=Cc2cccc(c2)OC(=O)c3ccc(cc3)[N+](=O)[O-]
Chemical ID:
5794854
Name [?]:
[3-[[2-(3-methylphenoxy)acetyl]aminoiminomethyl]phenyl] 4-nitrobenzoate
SMILES [?]:
Cc1cccc(c1)OCC(=O)NN=Cc2cccc(c2)OC(=O)c3ccc(cc3)[N+](=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H19N3O6
All Atoms:32
Heavy Atoms:32
Chiral Atoms:0
ZAP Information [?]
Total:5.42013
Area:700.444
Solvation:-12.091
Coulombic:-56.7438
Bond Count [?]
All:34
Single:21
Double:13
Rotors:10
Chiral:1
Rigid Segments:8
Chemical Properties
Molecular Weight:433.414
H-Bond Donors:1
H-Bond Acceptors:9
XLogP:5.38
LogP (Chemaxon):4.67

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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