Chemical ID: 7577091

C[NH+]1CCCC(C1)OC(=O)C(c2ccccc2)(C3CCCCC3)O
Chemical ID:
7577091
Name [?]:
(1-methyl-3,4,5,6-tetrahydro-2H-pyridin-3-yl) 2-cyclohexyl-2-hydroxy-2-phenyl-acetate
SMILES [?]:
C[NH+]1CCCC(C1)OC(=O)C(c2ccccc2)(C3CCCCC3)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H30NO3+
All Atoms:54
Heavy Atoms:24
Chiral Atoms:None
ZAP Information [?]
Total:-19.627
Area:532.138
Solvation:-32.9304
Coulombic:-9.95077
Bond Count [?]
All:26
Single:22
Double:4
Rotors:5
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:3.71
LogP (Chemaxon):None

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue