Chemical ID: 5844980

CCOc1ccc(cc1OC)C=NNC(=O)COc2ccccc2Cl
Chemical ID:
5844980
Name [?]:
2-(2-chlorophenoxy)-N-[(4-ethoxy-3-methoxy-phenyl)methyleneamino]acetamide
SMILES [?]:
CCOc1ccc(cc1OC)C=NNC(=O)COc2ccccc2Cl
InChi [?]:
InChI=1/C18H19ClN2O4/c1-3-24-16-9-8-13(10-17(16)23-2)11-20-21-18(22)12-25-15-7-5-4-6-14(15)19/h4-11H,3,12H2,1-2H3,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,11,2,22,21,23,20,6,5,8,12,17,7,24,19,4,9,15,25,13,14,16,10,3,18/rA:25nCCOCCCCCCOCCNNCOCOCCCCCCCl/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s10;s7;w12;s13;s14;d15;s15;s17;s18;s19;d20;s21;d22;d19s23;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H19ClN2O4
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:5.70933
Area:594.034
Solvation:-9.14153
Coulombic:-39.5055
Bond Count [?]
All:26
Single:18
Double:8
Rotors:9
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:362.807
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:4.28
LogP (Chemaxon):3.37

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Descriptor Annotations

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