Chemical ID: 5678977

CCCOc1ccc(cc1)C(=C2C(N(C(=O)C2=O)Cc3ccc[nH+]c3)c4cccc(c4)N(=O)=O)[O-]
Chemical ID:
5678977
Name [?]:
[2-(3-nitrophenyl)-4,5-dioxo-1-(1H-pyridin-5-ylmethyl)pyrrolidin-3-ylidene]-(4-propoxyphenyl)-methanolate
SMILES [?]:
CCCOc1ccc(cc1)C(=C2C(N(C(=O)C2=O)Cc3ccc[nH+]c3)c4cccc(c4)N(=O)=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C26H23N3O6
All Atoms:35
Heavy Atoms:35
Chiral Atoms:1
ZAP Information [?]
Total:-48.3246
Area:631.619
Solvation:-64.115
Coulombic:-43.1901
Bond Count [?]
All:38
Single:24
Double:14
Rotors:8
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:473.477
H-Bond Donors:0
H-Bond Acceptors:8
XLogP:3.6
LogP (Chemaxon):2.28

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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