Chemical ID: 6536940

CC(C)COc1cccc(c1)OCC(=O)Nc2ccc(c(c2)Cl)Cl
Chemical ID:
6536940
Name [?]:
N-(3,4-dichlorophenyl)-2-(3-isobutoxyphenoxy)-acetamide
SMILES [?]:
CC(C)COc1cccc(c1)OCC(=O)Nc2ccc(c(c2)Cl)Cl
InChi [?]:
InChI=1/C18H19Cl2NO3/c1-12(2)10-23-14-4-3-5-15(9-14)24-11-18(22)21-13-6-7-16(19)17(20)8-13/h3-9,12H,10-11H2,1-2H3,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,3,8,7,9,18,19,22,11,4,13,2,17,6,10,20,21,14,24,23,16,15,5,12/E:(1,2)/rA:24nCCCCOCCCCCCOCCONCCCCCCClCl/rB:s1;s2;s2;s4;s5;s6;d7;s8;d9;d6s10;s10;s12;s13;d14;s14;s16;s17;d18;s19;d20;d17s21;s21;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H19Cl2NO3
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:9.6321
Area:596.509
Solvation:-5.28063
Coulombic:-36.5617
Bond Count [?]
All:25
Single:18
Double:7
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:368.254
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.91
LogP (Chemaxon):4.87

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