Chemical ID: 4569743

Cc1cc2c(c(cc(=O)o2)C)c3c1c(co3)c4ccc5ccccc5c4
Chemical ID:
4569743
Name [?]:
None
SMILES [?]:
Cc1cc2c(c(cc(=O)o2)C)c3c1c(co3)c4ccc5ccccc5c4
InChi [?]:
InChI=1/C23H16O3/c1-13-9-19-22(14(2)10-20(24)26-19)23-21(13)18(12-25-23)17-8-7-15-5-3-4-6-16(15)11-17/h3-12H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,11,22,23,21,24,19,18,3,7,26,15,2,6,20,25,17,14,4,8,13,5,12,9,16,10/rA:26nCCCCCCCCOOCCCCCOCCCCCCCCCC/rB:s1;s2;d3;s4;s5;d6;s7;d8;s4s8;s6;d5;d2s12;s13;d14;s12s15;s14;s17;d18;s19;s20;d21;s22;d23;d20s24;d17s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H16O3
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:10.0863
Area:517.041
Solvation:-2.83977
Coulombic:-28.3589
Bond Count [?]
All:30
Single:19
Double:11
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:340.371
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:5.73
LogP (Chemaxon):6.31

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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