Chemical ID: 7293431

c1ccc(c(c1)C#N)OCC(=O)Nc2ccccc2Cl
Chemical ID:
7293431
Name [?]:
N-(2-chlorophenyl)-2-(2-cyanophenoxy)-acetamide
SMILES [?]:
c1ccc(c(c1)C#N)OCC(=O)Nc2ccccc2Cl
InChi [?]:
InChI=1/C15H11ClN2O2/c16-12-6-2-3-7-13(12)18-15(19)10-20-14-8-4-1-5-11(14)9-17/h1-8H,10H2,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,17,16,2,6,18,15,3,7,10,5,19,14,4,11,20,8,13,12,9/rA:20nCCCCCCCNOCCONCCCCCCCl/rB:s1;d2;s3;d4;d1s5;s5;t7;s4;s9;s10;d11;s11;s13;s14;d15;s16;d17;d14s18;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H11ClN2O2
All Atoms:31
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:7.89559
Area:490.81
Solvation:-4.37467
Coulombic:-32.9012
Bond Count [?]
All:21
Single:13
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:286.713
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.02
LogP (Chemaxon):2.56

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Descriptor Annotations

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