Chemical ID: 5398915

CNC(=O)COC(=O)c1ccc(c(c1)[N+](=O)[O-])N2CCOCC2
Chemical ID:
5398915
Name [?]:
methylcarbamoylmethyl 4-morpholino-3-nitro-benzoate
SMILES [?]:
CNC(=O)COC(=O)c1ccc(c(c1)[N+](=O)[O-])N2CCOCC2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C14H17N3O6
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:2.05315
Area:524.866
Solvation:-11.0685
Coulombic:-64.0988
Bond Count [?]
All:24
Single:18
Double:6
Rotors:7
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:323.301
H-Bond Donors:1
H-Bond Acceptors:9
XLogP:0.71
LogP (Chemaxon):0.39

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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