Chemical ID: 6567570

CCNc1ccc(cc1[N+](=O)[O-])C(=O)OCC(=O)Nc2ccc(cc2)OCC
Chemical ID:
6567570
Name [?]:
(4-ethoxyphenyl)carbamoylmethyl 4-ethylamino-3-nitro-benzoate
SMILES [?]:
CCNc1ccc(cc1[N+](=O)[O-])C(=O)OCC(=O)Nc2ccc(cc2)OCC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H21N3O6
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:6.12577
Area:640.533
Solvation:-9.88756
Coulombic:-71.0626
Bond Count [?]
All:29
Single:20
Double:9
Rotors:11
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:387.387
H-Bond Donors:2
H-Bond Acceptors:9
XLogP:3.52
LogP (Chemaxon):3.29

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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