Chemical ID: 3967359

C[N+](C)(C)CC#CCOC(=O)Nc1cccc(c1)Cl
Chemical ID:
3967359
Name [?]:
4-[(3-chlorophenyl)carbamoyloxy]but-2-ynyl-trimethyl-ammonium
SMILES [?]:
C[N+](C)(C)CC#CCOC(=O)Nc1cccc(c1)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C14H18ClN2O2+
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:-18.2735
Area:508.89
Solvation:-30.9957
Coulombic:-8.41598
Bond Count [?]
All:19
Single:14
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:281.758
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:0.98
LogP (Chemaxon):-1.78

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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