Chemical ID: 6402247

Cc1ccc(cc1)C(=O)NN=Cc2cc3c(cc2[N+](=O)[O-])OCO3
Chemical ID:
6402247
Name [?]:
4-methyl-N-[(6-nitrobenzo[1,3]dioxol-5-yl)methyleneamino]benzamide
SMILES [?]:
Cc1ccc(cc1)C(=O)NN=Cc2cc3c(cc2[N+](=O)[O-])OCO3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H13N3O5
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:3.10938
Area:509.29
Solvation:-9.62287
Coulombic:-45.2198
Bond Count [?]
All:26
Single:17
Double:9
Rotors:5
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:327.292
H-Bond Donors:1
H-Bond Acceptors:8
XLogP:3.96
LogP (Chemaxon):3.35

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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