Chemical ID: 6914340

C[NH+]1C2CCC1C(C(C2)OC(=O)c3ccccc3)C(=O)OC
Chemical ID:
6914340
Name [?]:
methyl 3-benzoyloxy-8-methyl-8-azoniabicyclo[3.2.1]octane-4-carboxylate
SMILES [?]:
C[NH+]1C2CCC1C(C(C2)OC(=O)c3ccccc3)C(=O)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H22NO4+
All Atoms:44
Heavy Atoms:22
Chiral Atoms:5
ZAP Information [?]
Total:-19.0578
Area:488.673
Solvation:-31.2746
Coulombic:-8.12353
Bond Count [?]
All:24
Single:19
Double:5
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:304.361
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.31
LogP (Chemaxon):1.74

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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