Chemical ID: 5797613

Cc1ccc(cc1)C(=O)NN=Cc2ccc(cc2)OC(=O)c3cccc(c3)[N+](=O)[O-]
Chemical ID:
5797613
Name [?]:
[4-[(4-methylbenzoyl)aminoiminomethyl]phenyl] 3-nitrobenzoate
SMILES [?]:
Cc1ccc(cc1)C(=O)NN=Cc2ccc(cc2)OC(=O)c3cccc(c3)[N+](=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H17N3O5
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:6.40455
Area:644.785
Solvation:-9.71509
Coulombic:-51.0763
Bond Count [?]
All:32
Single:19
Double:13
Rotors:8
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:403.388
H-Bond Donors:1
H-Bond Acceptors:8
XLogP:5.7
LogP (Chemaxon):4.89

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Experimental Annotations

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Descriptor Annotations

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