Chemical ID: 6990129

Cc1cccc(c1OCC(=O)Nc2ccccc2Cl)C
Chemical ID:
6990129
Name [?]:
N-(2-chlorophenyl)-2-(2,6-dimethylphenoxy)-acetamide
SMILES [?]:
Cc1cccc(c1OCC(=O)Nc2ccccc2Cl)C
InChi [?]:
InChI=1/C16H16ClNO2/c1-11-6-5-7-12(2)16(11)20-10-15(19)18-14-9-4-3-8-13(14)17/h3-9H,10H2,1-2H3,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,20,16,15,4,3,5,17,14,9,2,6,18,13,10,7,19,12,11,8/E:(1,2)(6,7)(11,12)/rA:20nCCCCCCCOCCONCCCCCCClC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;d10;s10;s12;s13;d14;s15;d16;d13s17;s18;s6;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H16ClNO2
All Atoms:36
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.90399
Area:488.484
Solvation:-3.30812
Coulombic:-30.6034
Bond Count [?]
All:21
Single:14
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:289.756
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.75
LogP (Chemaxon):3.68

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