Chemical ID: 5435499

c1cc(c(cc1C(=O)OCC(=O)N)[N+](=O)[O-])N2CCOCC2
Chemical ID:
5435499
Name [?]:
carbamoylmethyl 4-morpholino-3-nitro-benzoate
SMILES [?]:
c1cc(c(cc1C(=O)OCC(=O)N)[N+](=O)[O-])N2CCOCC2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C13H15N3O6
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:1.33887
Area:499.147
Solvation:-11.1398
Coulombic:-68.1891
Bond Count [?]
All:23
Single:17
Double:6
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:309.275
H-Bond Donors:2
H-Bond Acceptors:9
XLogP:0.19
LogP (Chemaxon):0.15

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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