Chemical ID: 4233960

Cc1cc(ccc1[N+](=O)[O-])OCC(=O)Nc2ccc(cc2)F
Chemical ID:
4233960
Name [?]:
N-(4-fluorophenyl)-2-(3-methyl-4-nitro-phenoxy)-acetamide
SMILES [?]:
Cc1cc(ccc1[N+](=O)[O-])OCC(=O)Nc2ccc(cc2)F
InChi [?]:
InChI=1/C15H13FN2O4/c1-10-8-13(6-7-14(10)18(20)21)22-9-15(19)17-12-4-2-11(16)3-5-12/h2-8H,9H2,1H3,(H,17,19)
InChi Info:
AuxInfo=1/1/N:1,18,20,17,21,5,6,3,12,2,19,16,4,7,13,22,15,8,14,9,10,11/E:(2,3)(4,5)(20,21)/CRV:18.5/rA:22nCCCCCCCN+OO-OCCONCCCCCCF/rB:s1;s2;d3;s4;d5;d2s6;s7;d8;s8;s4;s11;s12;d13;s13;s15;s16;d17;s18;d19;d16s20;s19;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H13FN2O4
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:2.11242
Area:496.442
Solvation:-10.2986
Coulombic:-42.3523
Bond Count [?]
All:23
Single:15
Double:8
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:304.273
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:2.83
LogP (Chemaxon):3.44

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