Chemical ID: 4146199

CC(C)c1ccc(cc1)OCC(=O)Nc2ccc(cc2)Cl
Chemical ID:
4146199
Name [?]:
N-(4-chlorophenyl)-2-(4-isopropylphenoxy)-acetamide
SMILES [?]:
CC(C)c1ccc(cc1)OCC(=O)Nc2ccc(cc2)Cl
InChi [?]:
InChI=1/C17H18ClNO2/c1-12(2)13-3-9-16(10-4-13)21-11-17(20)19-15-7-5-14(18)6-8-15/h3-10,12H,11H2,1-2H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,3,5,9,17,19,16,20,6,8,11,2,4,18,15,7,12,21,14,13,10/E:(1,2)(3,4)(5,6)(7,8)(9,10)/rA:21nCCCCCCCCCOCCONCCCCCCCl/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s7;s10;s11;d12;s12;s14;s15;d16;s17;d18;d15s19;s18;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H18ClNO2
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:9.19235
Area:523.899
Solvation:-3.90512
Coulombic:-29.9033
Bond Count [?]
All:22
Single:15
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:303.783
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.7
LogP (Chemaxon):4.59

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