Chemical ID: 6561959

Cc1c(cccc1[N+](=O)[O-])C(=O)OCC(=O)N2CCCC2
Chemical ID:
6561959
Name [?]:
pyrrolidin-1-ylcarbonylmethyl 2-methyl-3-nitro-benzoate
SMILES [?]:
Cc1c(cccc1[N+](=O)[O-])C(=O)OCC(=O)N2CCCC2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C14H16N2O5
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:4.06893
Area:488.039
Solvation:-8.13205
Coulombic:-47.3813
Bond Count [?]
All:22
Single:16
Double:6
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:292.287
H-Bond Donors:0
H-Bond Acceptors:7
XLogP:1.77
LogP (Chemaxon):1.51

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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