Chemical ID: 6987203

CCOc1cc(ccc1O)C=NNC(=O)COc2ccc(c(c2)C)Cl
Chemical ID:
6987203
Name [?]:
2-(4-chloro-3-methyl-phenoxy)-N-[(3-ethoxy-4-hydroxy-phenyl)methyleneamino]acetamide
SMILES [?]:
CCOc1cc(ccc1O)C=NNC(=O)COc2ccc(c(c2)C)Cl
InChi [?]:
InChI=1/C18H19ClN2O4/c1-3-24-17-9-13(4-7-16(17)22)10-20-21-18(23)11-25-14-5-6-15(19)12(2)8-14/h4-10,22H,3,11H2,1-2H3,(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,24,2,7,19,20,8,23,5,11,16,22,6,18,21,9,4,14,25,12,13,10,15,3,17/rA:25nCCOCCCCCCOCNNCOCOCCCCCCCCl/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s6;w11;s12;s13;d14;s14;s16;s17;s18;d19;s20;d21;d18s22;s22;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H19ClN2O4
All Atoms:44
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:7.22675
Area:612.74
Solvation:-8.09175
Coulombic:-48.4278
Bond Count [?]
All:26
Single:18
Double:8
Rotors:8
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:362.807
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:4.46
LogP (Chemaxon):3.81

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