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Chemical ID: 7706610

Cc1ccc(cc1)COc2ccc(cc2)C(=O)NN=Cc3cccc(c3)O

Chemical ID:

7706610

Name [?]:

None

SMILES [?]:

Cc1ccc(cc1)COc2ccc(cc2)C(=O)NN=Cc3cccc(c3)O

InChi [?]:

InChI=1/C22H20N2O3/c1-16-5-7-17(8-6-16)15-27-21-11-9-19(10-12-21)22(26)24-23-14-18-3-2-4-20(25)13-18/h2-14,25H,15H2,1H3,(H,24,26)

InChi Info:

AuxInfo=1/1/N:1,23,22,24,3,7,4,6,12,14,11,15,26,20,8,2,5,21,13,25,10,16,19,18,27,17,9/E:(5,6)(7,8)(9,10)(11,12)/rA:27nCCCCCCCCOCCCCCCCONNCCCCCCCO/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;s10;d11;s12;d13;d10s14;s13;d16;s16;s18;w19;s20;s21;d22;s23;d24;d21s25;s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₂H₂₀N₂O₃
All Atoms:	47
Heavy Atoms:	27
Chiral Atoms:	None

ZAP Information [?]

Total:	10.0291
Area:	625.281
Solvation:	-5.60293
Coulombic:	-44.6396

Bond Count [?]

All:	29
Single:	18
Double:	11
Rotors:	7
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	5.65
LogP (Chemaxon):	None

Name Annotations

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Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

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

Chemical Mix	Source	External ID	Descriptor	Value