Chemical ID: 6397641

CCc1ccc(cc1)NC(=O)COc2ccc(cc2C)Cl
Chemical ID:
6397641
Name [?]:
2-(4-chloro-2-methyl-phenoxy)-N-(4-ethylphenyl)-acetamide
SMILES [?]:
CCc1ccc(cc1)NC(=O)COc2ccc(cc2C)Cl
InChi [?]:
InChI=1/C17H18ClNO2/c1-3-13-4-7-15(8-5-13)19-17(20)11-21-16-9-6-14(18)10-12(16)2/h4-10H,3,11H2,1-2H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,20,2,4,8,16,5,7,15,18,12,19,3,17,6,14,10,21,9,11,13/E:(4,5)(7,8)/rA:21nCCCCCCCCNCOCOCCCCCCCCl/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;d10;s10;s12;s13;s14;d15;s16;d17;d14s18;s19;s17;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H18ClNO2
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:9.17776
Area:523.243
Solvation:-3.9033
Coulombic:-29.3833
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:4.42
LogP (Chemaxon):4.72

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