Chemical ID: 7707690

CCOc1ccc(cc1)C(=O)NCC(=O)NN=CC=Cc2ccccc2
Chemical ID:
7707690
Name [?]:
None
SMILES [?]:
CCOc1ccc(cc1)C(=O)NCC(=O)NN=CC=Cc2ccccc2
InChi [?]:
InChI=1/C20H21N3O3/c1-2-26-18-12-10-17(11-13-18)20(25)21-15-19(24)23-22-14-6-9-16-7-4-3-5-8-16/h3-14H,2,15H2,1H3,(H,21,25)(H,23,24)
InChi Info:
AuxInfo=1/1/N:1,2,24,23,25,19,22,26,20,6,8,5,9,18,13,21,7,4,14,10,12,17,16,15,11,3/E:(4,5)(7,8)(10,11)(12,13)/rA:26nCCOCCCCCCCONCCONNCCCCCCCCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s7;d10;s10;s12;s13;d14;s14;s16;w17;s18;w19;s20;s21;d22;s23;d24;d21s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H21N3O3
All Atoms:47
Heavy Atoms:26
Chiral Atoms:None
ZAP Information [?]
Total:10.3073
Area:634.613
Solvation:-5.55799
Coulombic:-49.1084
Bond Count [?]
All:27
Single:17
Double:10
Rotors:10
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:3.78
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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