Chemical ID: 5501758

CN(c1ccccc1)C(=O)COC(=O)c2ccc(c(c2)[N+](=O)[O-])N
Chemical ID:
5501758
Name [?]:
(methyl-phenyl-carbamoyl)methyl 4-amino-3-nitro-benzoate
SMILES [?]:
CN(c1ccccc1)C(=O)COC(=O)c2ccc(c(c2)[N+](=O)[O-])N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H15N3O5
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:4.72737
Area:544.343
Solvation:-8.88119
Coulombic:-64.0855
Bond Count [?]
All:25
Single:16
Double:9
Rotors:7
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:329.308
H-Bond Donors:2
H-Bond Acceptors:8
XLogP:2.43
LogP (Chemaxon):2.27

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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