Chemical ID: 4838059

c1cc(ccc1C2C(=C(C(=O)N2CCO)O)C(=O)c3ccc(cc3)[N+](=O)[O-])[N+](=O)[O-]
Chemical ID:
4838059
Name [?]:
3-hydroxy-1-(2-hydroxyethyl)-4-(4-nitrobenzoyl)-5-(4-nitrophenyl)-5H-pyrrol-2-one
SMILES [?]:
c1cc(ccc1C2C(=C(C(=O)N2CCO)O)C(=O)c3ccc(cc3)[N+](=O)[O-])[N+](=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H15N3O8
All Atoms:30
Heavy Atoms:30
Chiral Atoms:1
ZAP Information [?]
Total:-0.818026
Area:616.396
Solvation:-16.2279
Coulombic:-81.486
Bond Count [?]
All:32
Single:21
Double:11
Rotors:7
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:413.338
H-Bond Donors:2
H-Bond Acceptors:11
XLogP:2.03
LogP (Chemaxon):1.69

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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