Chemical ID: 7703889

CCc1ccc(cc1)NC(=O)C(=O)NN=Cc2cccc(c2O)CC=C
Chemical ID:
7703889
Name [?]:
None
SMILES [?]:
CCc1ccc(cc1)NC(=O)C(=O)NN=Cc2cccc(c2O)CC=C
InChi [?]:
InChI=1/C20H21N3O3/c1-3-6-15-7-5-8-16(18(15)24)13-21-23-20(26)19(25)22-17-11-9-14(4-2)10-12-17/h3,5,7-13,24H,1,4,6H2,2H3,(H,22,25)(H,23,26)
InChi Info:
AuxInfo=1/1/N:26,1,25,2,19,24,20,18,4,8,5,7,16,3,21,17,6,22,10,12,15,9,14,23,11,13/E:(9,10)(11,12)/rA:26nCCCCCCCCNCOCONNCCCCCCCOCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;d10;s10;d12;s12;s14;w15;s16;s17;d18;s19;d20;d17s21;s22;s21;s24;d25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H21N3O3
All Atoms:47
Heavy Atoms:26
Chiral Atoms:None
ZAP Information [?]
Total:10.7639
Area:601.746
Solvation:-4.27972
Coulombic:-62.009
Bond Count [?]
All:27
Single:17
Double:10
Rotors:9
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:4.6
LogP (Chemaxon):None

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Descriptor Annotations

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