Chemical ID: 4126455

CCN(CC)CCN1C(C(=C(C1=O)O)C(=O)c2ccc(c(c2)C)OC)c3ccc(cc3)[N+](=O)[O-]
Chemical ID:
4126455
Name [?]:
1-(2-diethylaminoethyl)-3-hydroxy-4-(4-methoxy-3-methyl-benzoyl)-5-(4-nitrophenyl)-5H-pyrrol-2-one
SMILES [?]:
CCN(CC)CCN1C(C(=C(C1=O)O)C(=O)c2ccc(c(c2)C)OC)c3ccc(cc3)[N+](=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H29N3O6
All Atoms:34
Heavy Atoms:34
Chiral Atoms:1
ZAP Information [?]
Total:6.51645
Area:710.256
Solvation:-11.2399
Coulombic:-66.2926
Bond Count [?]
All:36
Single:26
Double:10
Rotors:10
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:467.514
H-Bond Donors:1
H-Bond Acceptors:9
XLogP:3.81
LogP (Chemaxon):0.45

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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