Chemical ID: 7491585

Cc1cc(cc(c1)OCC(=O)Nc2ccc(c(c2)Cl)OC)C
Chemical ID:
7491585
Name [?]:
N-(3-chloro-4-methoxy-phenyl)-2-(3,5-dimethylphenoxy)-acetamide
SMILES [?]:
Cc1cc(cc(c1)OCC(=O)Nc2ccc(c(c2)Cl)OC)C
InChi [?]:
InChI=1/C17H18ClNO3/c1-11-6-12(2)8-14(7-11)22-10-17(20)19-13-4-5-16(21-3)15(18)9-13/h4-9H,10H2,1-3H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,22,21,14,15,3,7,5,18,9,2,4,13,6,17,16,10,19,12,11,20,8/E:(1,2)(7,8)(11,12)/rA:22nCCCCCCCOCCONCCCCCCClOCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s9;d10;s10;s12;s13;d14;s15;d16;d13s17;s17;s16;s20;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H18ClNO3
All Atoms:40
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:7.91097
Area:534.664
Solvation:-5.45562
Coulombic:-35.3432
Bond Count [?]
All:23
Single:16
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:319.782
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.09
LogP (Chemaxon):4.08

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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