Chemical ID: 6631118

CCOc1ccc(cc1)NC(=O)C(=O)NN=Cc2cc(ccc2O)OC
Chemical ID:
6631118
Name [?]:
N-(4-ethoxyphenyl)-N'-[(2-hydroxy-5-methoxy-phenyl)methyleneamino]oxamide
SMILES [?]:
CCOc1ccc(cc1)NC(=O)C(=O)NN=Cc2cc(ccc2O)OC
InChi [?]:
InChI=1/C18H19N3O5/c1-3-26-14-6-4-13(5-7-14)20-17(23)18(24)21-19-11-12-10-15(25-2)8-9-16(12)22/h4-11,22H,3H2,1-2H3,(H,20,23)(H,21,24)
InChi Info:
AuxInfo=1/1/N:1,26,2,6,8,5,9,21,22,19,17,18,7,4,20,23,11,13,16,10,15,24,12,14,25,3/E:(4,5)(6,7)/rA:26nCCOCCCCCCNCOCONNCCCCCCCOOC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s7;s10;d11;s11;d13;s13;s15;w16;s17;s18;d19;s20;d21;d18s22;s23;s20;s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H19N3O5
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:8.40493
Area:582.801
Solvation:-6.1651
Coulombic:-73.22
Bond Count [?]
All:27
Single:18
Double:9
Rotors:9
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:357.361
H-Bond Donors:3
H-Bond Acceptors:8
XLogP:2.87
LogP (Chemaxon):2.53

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