Chemical ID: 4544434

CC(C)Oc1ccccc1C=NNC(=O)COc2ccccc2Cl
Chemical ID:
4544434
Name [?]:
2-(2-chlorophenoxy)-N-[(2-isopropoxyphenyl)methyleneamino]acetamide
SMILES [?]:
CC(C)Oc1ccccc1C=NNC(=O)COc2ccccc2Cl
InChi [?]:
InChI=1/C18H19ClN2O3/c1-13(2)24-16-9-5-3-7-14(16)11-20-21-18(22)12-23-17-10-6-4-8-15(17)19/h3-11,13H,12H2,1-2H3,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,3,8,21,7,20,9,22,6,19,11,16,2,10,23,5,18,14,24,12,13,15,17,4/E:(1,2)/rA:24nCCCOCCCCCCCNNCOCOCCCCCCCl/rB:s1;s2;s2;s4;s5;d6;s7;d8;d5s9;s10;w11;s12;s13;d14;s14;s16;s17;s18;d19;s20;d21;d18s22;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H19ClN2O3
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:7.98128
Area:575.27
Solvation:-6.40046
Coulombic:-34.6524
Bond Count [?]
All:25
Single:17
Double:8
Rotors:8
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:346.808
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:5.1
LogP (Chemaxon):4.04

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