Chemical ID: 7552430

CC[NH+](CC)CCn1c2ccc(cc2nc1Cc3ccc(cc3)OCC)[N+](=O)[O-]
Chemical ID:
7552430
Name [?]:
2-[2-[(4-ethoxyphenyl)methyl]-5-nitro-benzoimidazol-1-yl]ethyl-diethyl-ammonium
SMILES [?]:
CC[NH+](CC)CCn1c2ccc(cc2nc1Cc3ccc(cc3)OCC)[N+](=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H29N4O3+
All Atoms:58
Heavy Atoms:29
Chiral Atoms:None
ZAP Information [?]
Total:-26.5601
Area:634.637
Solvation:-42.4261
Coulombic:4.54309
Bond Count [?]
All:31
Single:23
Double:8
Rotors:10
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:4.19
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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