Chemical ID: 5601036

Cc1cc(ccc1OCC(=O)NN=Cc2ccccc2)Cl
Chemical ID:
5601036
Name [?]:
N-benzylideneamino-2-(4-chloro-2-methyl-phenoxy)-acetamide
SMILES [?]:
Cc1cc(ccc1OCC(=O)NN=Cc2ccccc2)Cl
InChi [?]:
InChI=1/C16H15ClN2O2/c1-12-9-14(17)7-8-15(12)21-11-16(20)19-18-10-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,18,17,19,16,20,5,6,3,14,9,2,15,4,7,10,21,13,12,11,8/E:(3,4)(5,6)/rA:21nCCCCCCCOCCONNCCCCCCCCl/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;d10;s10;s12;w13;s14;s15;d16;s17;d18;d15s19;s4;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H15ClN2O2
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:7.69405
Area:517.184
Solvation:-5.23556
Coulombic:-26.9454
Bond Count [?]
All:22
Single:14
Double:8
Rotors:6
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:302.755
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.52
LogP (Chemaxon):4.0

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