Chemical ID: 6351389

CCOc1ccc(cc1)C(=NNC(=O)c2ccc(c(c2)OC)OC)C
Chemical ID:
6351389
Name [?]:
N-[1-(4-ethoxyphenyl)ethylideneamino]-3,4-dimethoxy-benzamide
SMILES [?]:
CCOc1ccc(cc1)C(=NNC(=O)c2ccc(c(c2)OC)OC)C
InChi [?]:
InChI=1/C19H22N2O4/c1-5-25-16-9-6-14(7-10-16)13(2)20-21-19(22)15-8-11-17(23-3)18(12-15)24-4/h6-12H,5H2,1-4H3,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,25,24,22,2,6,8,16,5,9,17,20,10,7,15,4,18,19,13,11,12,14,23,21,3/E:(6,7)(9,10)/rA:25nCCOCCCCCCCNNCOCCCCCCOCOCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s7;w10;s11;s12;d13;s13;s15;d16;s17;d18;d15s19;s19;s21;s18;s23;s10;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H22N2O4
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:6.96498
Area:572.078
Solvation:-7.33698
Coulombic:-40.3952
Bond Count [?]
All:26
Single:18
Double:8
Rotors:8
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:342.389
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:4.04
LogP (Chemaxon):2.46

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue