Chemical ID: 7708496

Cc1ccc(cc1)OCC(=O)Nc2ccccc2Oc3ccccc3
Chemical ID:
7708496
Name [?]:
None
SMILES [?]:
Cc1ccc(cc1)OCC(=O)Nc2ccccc2Oc3ccccc3
InChi [?]:
InChI=1/C21H19NO3/c1-16-11-13-17(14-12-16)24-15-21(23)22-19-9-5-6-10-20(19)25-18-7-3-2-4-8-18/h2-14H,15H2,1H3,(H,22,23)
InChi Info:
AuxInfo=1/1/N:1,23,22,24,15,16,21,25,14,17,3,7,4,6,9,2,5,20,13,18,10,12,11,8,19/E:(3,4)(7,8)(11,12)(13,14)/rA:25nCCCCCCCOCCONCCCCCCOCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;d10;s10;s12;s13;d14;s15;d16;d13s17;s18;s19;s20;d21;s22;d23;d20s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H19NO3
All Atoms:44
Heavy Atoms:25
Chiral Atoms:None
ZAP Information [?]
Total:9.62387
Area:557.053
Solvation:-4.30245
Coulombic:-38.893
Bond Count [?]
All:27
Single:17
Double:10
Rotors:7
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:4.59
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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