Chemical ID: 5721668

c1ccc(cc1)C(=O)COC(=O)c2cc(ccc2O)N3C(=O)C4CC=CCC4C3=O
Chemical ID:
5721668
Name [?]:
phenacyl 5-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-2-hydroxy-benzoate
SMILES [?]:
c1ccc(cc1)C(=O)COC(=O)c2cc(ccc2O)N3C(=O)C4CC=CCC4C3=O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H19NO6
All Atoms:30
Heavy Atoms:30
Chiral Atoms:2
ZAP Information [?]
Total:9.2188
Area:606.786
Solvation:-5.95085
Coulombic:-67.9646
Bond Count [?]
All:33
Single:22
Double:11
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:405.4
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:3.44
LogP (Chemaxon):2.98

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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