Chemical ID: 4159980

CCc1cccc(c1)OCC(=O)Nc2cc(ccc2Cl)C(F)(F)F
Chemical ID:
4159980
Name [?]:
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(3-ethylphenoxy)-acetamide
SMILES [?]:
CCc1cccc(c1)OCC(=O)Nc2cc(ccc2Cl)C(F)(F)F
InChi [?]:
InChI=1/C17H15ClF3NO2/c1-2-11-4-3-5-13(8-11)24-10-16(23)22-15-9-12(17(19,20)21)6-7-14(15)18/h3-9H,2,10H2,1H3,(H,22,23)
InChi Info:
AuxInfo=1/1/N:1,2,5,4,6,17,18,8,15,10,3,16,7,19,14,11,21,20,22,23,24,13,12,9/E:(19,20,21)/rA:24nCCCCCCCCOCCONCCCCCCClCFFF/rB:s1;s2;s3;d4;s5;d6;d3s7;s7;s9;s10;d11;s11;s13;s14;d15;s16;d17;d14s18;s19;s16;s21;s21;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H15ClF3NO2
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:9.19433
Area:544.682
Solvation:-4.42271
Coulombic:-48.0938
Bond Count [?]
All:25
Single:18
Double:7
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:357.754
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.12
LogP (Chemaxon):4.49

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