Chemical ID: 4359560

Cc1cc(ccc1Cl)OCC(=O)Nc2ccc(c(c2)[N+](=O)[O-])Cl
Chemical ID:
4359560
Name [?]:
2-(4-chloro-3-methyl-phenoxy)-N-(4-chloro-3-nitro-phenyl)-acetamide
SMILES [?]:
Cc1cc(ccc1Cl)OCC(=O)Nc2ccc(c(c2)[N+](=O)[O-])Cl
InChi [?]:
InChI=1/C15H12Cl2N2O4/c1-9-6-11(3-5-12(9)16)23-8-15(20)18-10-2-4-13(17)14(7-10)19(21)22/h2-7H,8H2,1H3,(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,15,5,16,6,3,19,10,2,14,4,7,17,18,11,8,23,13,20,12,21,22,9/E:(21,22)/CRV:19.5/rA:23nCCCCCCCClOCCONCCCCCCN+OO-Cl/rB:s1;s2;d3;s4;d5;d2s6;s7;s4;s9;s10;d11;s11;s13;s14;d15;s16;d17;d14s18;s18;d20;s20;s17;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H12Cl2N2O4
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:4.05785
Area:546.671
Solvation:-9.60893
Coulombic:-38.8086
Bond Count [?]
All:24
Single:16
Double:8
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:355.172
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:3.91
LogP (Chemaxon):4.33

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