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Chemical ID: 7746189

CCOc1ccc(cc1)C2CC(=NN2C(=O)c3ccco3)c4ccccc4O

Chemical ID:

7746189

Name [?]:

None

SMILES [?]:

CCOc1ccc(cc1)C2CC(=NN2C(=O)c3ccco3)c4ccccc4O

InChi [?]:

InChI=1/C22H20N2O4/c1-2-27-16-11-9-15(10-12-16)19-14-18(17-6-3-4-7-20(17)25)23-24(19)22(26)21-8-5-13-28-21/h3-13,19,25H,2,14H2,1H3

InChi Info:

AuxInfo=1/0/N:1,2,24,25,19,23,26,18,6,8,5,9,20,11,7,4,22,12,10,27,17,15,13,14,28,16,3,21/E:(9,10)(11,12)/rA:28cCCOCCCCCCCCCNNCOCCCCOCCCCCCO/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s7;s10;s11;d12;s10s13;s14;d15;s15;d17;s18;d19;s17s20;s12;s22;d23;s24;d25;d22s26;s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₂H₂₀N₂O₄
All Atoms:	48
Heavy Atoms:	28
Chiral Atoms:	None

ZAP Information [?]

Total:	8.59823
Area:	579.752
Solvation:	-5.89558
Coulombic:	-47.6268

Bond Count [?]

All:	31
Single:	21
Double:	10
Rotors:	6
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	4.1
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