Chemical ID: 4410455

c1cc(cc(c1)F)NC(=O)COc2ccc(cc2)[N+](=O)[O-]
Chemical ID:
4410455
Name [?]:
N-(3-fluorophenyl)-2-(4-nitrophenoxy)-acetamide
SMILES [?]:
c1cc(cc(c1)F)NC(=O)COc2ccc(cc2)[N+](=O)[O-]
InChi [?]:
InChI=1/C14H11FN2O4/c15-10-2-1-3-11(8-10)16-14(18)9-21-13-6-4-12(5-7-13)17(19)20/h1-8H,9H2,(H,16,18)
InChi Info:
AuxInfo=1/1/N:1,6,2,15,17,14,18,4,11,5,3,16,13,9,7,8,19,10,20,21,12/E:(4,5)(6,7)(19,20)/CRV:17.5/rA:21nCCCCCCFNCOCOCCCCCCN+OO-/rB:s1;d2;s3;d4;d1s5;s5;s3;s8;d9;s9;s11;s12;s13;d14;s15;d16;d13s17;s16;d19;s19;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H11FN2O4
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:1.29748
Area:481.035
Solvation:-10.7284
Coulombic:-41.7383
Bond Count [?]
All:22
Single:14
Double:8
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:290.247
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:2.61
LogP (Chemaxon):2.97

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Descriptor Annotations

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