Chemical ID: 4084732

CCOC(=O)C=C1CC(=O)Nc2c(non2)N1
Chemical ID:
4084732
Name [?]:
ethyl 2-(3-oxo-9-oxa-2,6,8,10-tetrazabicyclo[5.3.0]deca-7,10-dien-5-ylidene)acetate
SMILES [?]:
CCOC(=O)C=C1CC(=O)Nc2c(non2)N1
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C9H10N4O4
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:6.80868
Area:396.375
Solvation:-3.1007
Coulombic:-53.5951
Bond Count [?]
All:18
Single:13
Double:5
Rotors:3
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:238.2
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:1.12
LogP (Chemaxon):-0.3

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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